Browse entries in the PDBbind-CN Database
HEADER 2LYB_COMPLEX COMPND 2LYB_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 131 GLY ALA ARG ALA SER VAL LEU SER GLY GLY GLU LEU ASP SEQRES 2 A 131 LYS TRP GLU LYS ILE ARG LEU ARG PRO GLY GLY LYS LYS SEQRES 3 A 131 GLN TYR LYS LEU LYS HIS ILE VAL TRP ALA SER ARG GLU SEQRES 4 A 131 LEU GLU ARG PHE ALA VAL ASN PRO GLY LEU LEU GLU THR SEQRES 5 A 131 SER GLU GLY CYS ARG GLN ILE LEU GLY GLN LEU GLN PRO SEQRES 6 A 131 SER LEU GLN THR GLY SER GLU GLU LEU ARG SER LEU TYR SEQRES 7 A 131 ASN THR ILE ALA VAL LEU TYR CYS VAL HIS GLN ARG ILE SEQRES 8 A 131 ASP VAL LYS ASP THR LYS GLU ALA LEU ASP LYS ILE GLU SEQRES 9 A 131 GLU GLU GLN ASN LYS SER LYS LYS LYS ALA GLN GLN ALA SEQRES 10 A 131 ALA ALA ASP THR GLY ASN ASN SER GLN VAL SER GLN ASN SEQRES 11 A 131 TYR HET UNN A 132 75 ATOM 1 N GLY A 2 1.330 0.000 0.000 1.00 13.00 N ATOM 2 CA GLY A 2 2.071 0.001 -1.247 1.00 45.03 C ATOM 3 C GLY A 2 1.832 1.256 -2.063 1.00 44.00 C ATOM 4 O GLY A 2 0.689 1.662 -2.270 1.00 21.34 O ATOM 5 HA3 GLY A 2 1.765 -0.863 -1.837 1.00 0.00 H ATOM 6 HA2 GLY A 2 3.135 -0.073 -1.022 1.00 0.00 H ATOM 7 HN3 GLY A 2 0.312 0.062 -0.203 1.00 0.00 H ATOM 8 HN2 GLY A 2 1.620 0.817 0.575 1.00 0.00 H ATOM 9 HN1 GLY A 2 1.529 -0.879 0.519 1.00 0.00 H ATOM 10 N ALA A 3 2.914 1.874 -2.527 1.00 21.53 N ATOM 11 CA ALA A 3 2.817 3.090 -3.324 1.00 75.54 C ATOM 12 C ALA A 3 3.371 2.871 -4.728 1.00 40.21 C ATOM 13 O ALA A 3 2.710 3.175 -5.721 1.00 52.21 O ATOM 14 CB ALA A 3 3.550 4.232 -2.637 1.00 74.10 C ATOM 15 HA ALA A 3 1.763 3.353 -3.414 1.00 0.00 H ATOM 16 HB1 ALA A 3 3.105 4.411 -1.658 1.00 0.00 H ATOM 17 HB2 ALA A 3 4.601 3.968 -2.517 1.00 0.00 H ATOM 18 HB3 ALA A 3 3.468 5.133 -3.245 1.00 0.00 H ATOM 19 H ALA A 3 3.853 1.480 -2.316 1.00 0.00 H ATOM 20 N ARG A 4 4.588 2.344 -4.803 1.00 25.51 N ATOM 21 CA ARG A 4 5.232 2.087 -6.085 1.00 63.45 C ATOM 22 C ARG A 4 5.897 0.713 -6.095 1.00 3.35 C ATOM 23 O ARG A 4 7.053 0.570 -5.698 1.00 65.01 O ATOM 24 CB ARG A 4 6.270 3.170 -6.385 1.00 62.32 C ATOM 25 CG ARG A 4 7.201 3.461 -5.219 1.00 53.01 C ATOM 26 CD ARG A 4 8.661 3.344 -5.629 1.00 15.43 C ATOM 27 NE ARG A 4 9.045 4.379 -6.585 1.00 70.01 N ATOM 28 CZ ARG A 4 9.252 5.648 -6.251 1.00 60.14 C ATOM 29 NH1 ARG A 4 9.113 6.037 -4.991 1.00 73.35 N ATOM 30 NH2 ARG A 4 9.600 6.531 -7.179 1.00 32.12 N ATOM 31 HA ARG A 4 4.464 2.105 -6.858 1.00 0.00 H ATOM 32 HB2 ARG A 4 6.872 2.845 -7.234 1.00 0.00 H ATOM 33 HB3 ARG A 4 5.744 4.089 -6.644 1.00 0.00 H ATOM 34 HG2 ARG A 4 7.014 4.473 -4.860 1.00 0.00 H ATOM 35 HG3 ARG A 4 7.000 2.749 -4.418 1.00 0.00 H ATOM 36 HD2 ARG A 4 8.822 2.367 -6.084 1.00 0.00 H ATOM 37 HD3 ARG A 4 9.285 3.436 -4.740 1.00 0.00 H ATOM 38 HE ARG A 4 9.163 4.108 -7.582 1.00 0.00 H ATOM 39 HH12 ARG A 4 9.276 7.031 -4.733 1.00 0.00 H ATOM 40 HH11 ARG A 4 8.841 5.348 -4.261 1.00 0.00 H ATOM 41 HH22 ARG A 4 9.762 7.524 -6.917 1.00 0.00 H ATOM 42 HH21 ARG A 4 9.711 6.230 -8.168 1.00 0.00 H ATOM 43 H ARG A 4 5.094 2.109 -3.925 1.00 0.00 H ATOM 44 N ALA A 5 5.158 -0.293 -6.549 1.00 62.31 N ATOM 45 CA ALA A 5 5.676 -1.654 -6.611 1.00 64.31 C ATOM 46 C ALA A 5 6.830 -1.758 -7.603 1.00 52.13 C ATOM 47 O ALA A 5 6.858 -1.054 -8.613 1.00 10.13 O ATOM 48 CB ALA A 5 4.566 -2.625 -6.986 1.00 25.10 C ATOM 49 HA ALA A 5 6.055 -1.917 -5.624 1.00 0.00 H ATOM 50 HB1 ALA A 5 3.776 -2.578 -6.237 1.00 0.00 H ATOM 51 HB2 ALA A 5 4.161 -2.353 -7.961 1.00 0.00 H ATOM 52 HB3 ALA A 5 4.969 -3.637 -7.028 1.00 0.00 H ATOM 53 H ALA A 5 4.186 -0.105 -6.868 1.00 0.00 H ATOM 54 N SER A 6 7.780 -2.639 -7.309 1.00 61.40 N ATOM 55 CA SER A 6 8.939 -2.832 -8.173 1.00 53.44 C ATOM 56 C SER A 6 9.629 -4.158 -7.870 1.00 11.11 C ATOM 57 O SER A 6 10.413 -4.261 -6.927 1.00 22.44 O ATOM 58 CB SER A 6 9.928 -1.677 -8.000 1.00 31.40 C ATOM 59 OG SER A 6 10.276 -1.111 -9.252 1.00 33.53 O ATOM 60 HA SER A 6 8.592 -2.852 -9.206 1.00 0.00 H ATOM 61 HB2 SER A 6 10.830 -2.050 -7.515 1.00 0.00 H ATOM 62 HB3 SER A 6 9.472 -0.908 -7.376 1.00 0.00 H ATOM 63 HG SER A 6 10.915 -0.368 -9.111 1.00 0.00 H ATOM 64 H SER A 6 7.695 -3.205 -6.441 1.00 0.00 H ATOM 65 N VAL A 7 9.331 -5.171 -8.677 1.00 31.20 N ATOM 66 CA VAL A 7 9.922 -6.492 -8.497 1.00 4.41 C ATOM 67 C VAL A 7 11.293 -6.575 -9.160 1.00 54.01 C ATOM 68 O VAL A 7 12.311 -6.739 -8.487 1.00 63.24 O ATOM 69 CB VAL A 7 9.017 -7.596 -9.074 1.00 12.21 C ATOM 70 CG1 VAL A 7 9.633 -8.967 -8.842 1.00 72.10 C ATOM 71 CG2 VAL A 7 7.626 -7.517 -8.463 1.00 51.21 C ATOM 72 HA VAL A 7 10.030 -6.647 -7.423 1.00 0.00 H ATOM 73 HB VAL A 7 8.926 -7.443 -10.149 1.00 0.00 H ATOM 74 HG11 VAL A 7 10.606 -9.014 -9.332 1.00 0.00 H ATOM 75 HG12 VAL A 7 9.755 -9.133 -7.772 1.00 0.00 H ATOM 76 HG13 VAL A 7 8.978 -9.733 -9.257 1.00 0.00 H ATOM 77 HG21 VAL A 7 7.697 -7.645 -7.383 1.00 0.00 H ATOM 78 HG22 VAL A 7 7.187 -6.545 -8.687 1.00 0.00 H ATOM 79 HG23 VAL A 7 7.001 -8.305 -8.883 1.00 0.00 H ATOM 80 H VAL A 7 8.660 -5.018 -9.456 1.00 0.00 H ATOM 81 N LEU A 8 11.311 -6.460 -10.483 1.00 71.55 N ATOM 82 CA LEU A 8 12.557 -6.522 -11.240 1.00 20.24 C ATOM 83 C LEU A 8 12.818 -5.208 -11.968 1.00 12.42 C ATOM 84 O LEU A 8 12.011 -4.770 -12.788 1.00 13.13 O ATOM 85 CB LEU A 8 12.510 -7.675 -12.244 1.00 42.55 C ATOM 86 CG LEU A 8 12.292 -9.069 -11.657 1.00 33.22 C ATOM 87 CD1 LEU A 8 12.369 -10.126 -12.748 1.00 31.15 C ATOM 88 CD2 LEU A 8 13.311 -9.353 -10.563 1.00 43.15 C ATOM 89 HA LEU A 8 13.372 -6.694 -10.537 1.00 0.00 H ATOM 90 HB2 LEU A 8 11.697 -7.476 -12.942 1.00 0.00 H ATOM 91 HB3 LEU A 8 13.457 -7.685 -12.784 1.00 0.00 H ATOM 92 HG LEU A 8 11.296 -9.104 -11.215 1.00 0.00 H ATOM 93 HD21 LEU A 8 14.316 -9.298 -10.981 1.00 0.00 H ATOM 94 HD22 LEU A 8 13.205 -8.614 -9.769 1.00 0.00 H ATOM 95 HD23 LEU A 8 13.139 -10.350 -10.158 1.00 0.00 H ATOM 96 HD11 LEU A 8 11.599 -9.932 -13.495 1.00 0.00 H ATOM 97 HD12 LEU A 8 13.351 -10.090 -13.219 1.00 0.00 H ATOM 98 HD13 LEU A 8 12.211 -11.111 -12.309 1.00 0.00 H ATOM 99 H LEU A 8 10.415 -6.322 -10.992 1.00 0.00 H ATOM 100 N SER A 9 13.951 -4.583 -11.664 1.00 64.51 N ATOM 101 CA SER A 9 14.318 -3.318 -12.289 1.00 2.15 C ATOM 102 C SER A 9 14.713 -3.526 -13.747 1.00 63.23 C ATOM 103 O SER A 9 14.555 -4.616 -14.295 1.00 62.24 O ATOM 104 CB SER A 9 15.471 -2.663 -11.525 1.00 31.23 C ATOM 105 OG SER A 9 16.722 -3.020 -12.086 1.00 23.34 O ATOM 106 HA SER A 9 13.449 -2.660 -12.257 1.00 0.00 H ATOM 107 HB2 SER A 9 15.441 -2.989 -10.485 1.00 0.00 H ATOM 108 HB3 SER A 9 15.357 -1.580 -11.568 1.00 0.00 H ATOM 109 HG SER A 9 17.448 -2.584 -11.574 1.00 0.00 H ATOM 110 H SER A 9 14.592 -5.007 -10.963 1.00 0.00 H ATOM 111 N GLY A 10 15.229 -2.471 -14.371 1.00 72.00 N ATOM 112 CA GLY A 10 15.639 -2.558 -15.760 1.00 53.34 C ATOM 113 C GLY A 10 16.617 -3.689 -16.007 1.00 34.31 C ATOM 114 O GLY A 10 16.426 -4.497 -16.915 1.00 30.21 O ATOM 115 HA3 GLY A 10 16.112 -1.618 -16.045 1.00 0.00 H ATOM 116 HA2 GLY A 10 14.755 -2.719 -16.376 1.00 0.00 H ATOM 117 H GLY A 10 15.340 -1.573 -13.857 1.00 0.00 H ATOM 118 N GLY A 11 17.669 -3.747 -15.196 1.00 62.24 N ATOM 119 CA GLY A 11 18.666 -4.791 -15.349 1.00 1.34 C ATOM 120 C GLY A 11 18.113 -6.169 -15.047 1.00 60.41 C ATOM 121 O GLY A 11 18.327 -7.111 -15.810 1.00 2.12 O ATOM 122 HA3 GLY A 11 19.492 -4.588 -14.668 1.00 0.00 H ATOM 123 HA2 GLY A 11 19.032 -4.778 -16.376 1.00 0.00 H ATOM 124 H GLY A 11 17.779 -3.037 -14.444 1.00 0.00 H ATOM 125 N GLU A 12 17.401 -6.289 -13.931 1.00 10.32 N ATOM 126 CA GLU A 12 16.818 -7.564 -13.530 1.00 2.22 C ATOM 127 C GLU A 12 15.827 -8.063 -14.578 1.00 3.54 C ATOM 128 O GLU A 12 15.673 -9.268 -14.778 1.00 52.05 O ATOM 129 CB GLU A 12 16.120 -7.427 -12.175 1.00 75.14 C ATOM 130 CG GLU A 12 16.967 -6.735 -11.121 1.00 33.55 C ATOM 131 CD GLU A 12 16.322 -6.756 -9.748 1.00 74.54 C ATOM 132 OE1 GLU A 12 15.483 -5.873 -9.474 1.00 55.25 O ATOM 133 OE2 GLU A 12 16.656 -7.655 -8.949 1.00 34.52 O ATOM 134 HA GLU A 12 17.625 -8.292 -13.443 1.00 0.00 H ATOM 135 HB2 GLU A 12 15.205 -6.851 -12.315 1.00 0.00 H ATOM 136 HB3 GLU A 12 15.868 -8.424 -11.815 1.00 0.00 H ATOM 137 HG2 GLU A 12 17.932 -7.239 -11.062 1.00 0.00 H ATOM 138 HG3 GLU A 12 17.118 -5.698 -11.420 1.00 0.00 H ATOM 139 H GLU A 12 17.256 -5.453 -13.329 1.00 0.00 H ATOM 140 N LEU A 13 15.158 -7.127 -15.242 1.00 73.43 N ATOM 141 CA LEU A 13 14.181 -7.470 -16.270 1.00 34.52 C ATOM 142 C LEU A 13 14.849 -8.183 -17.441 1.00 22.32 C ATOM 143 O LEU A 13 14.423 -9.264 -17.848 1.00 55.22 O ATOM 144 CB LEU A 13 13.468 -6.211 -16.764 1.00 52.35 C ATOM 145 CG LEU A 13 12.168 -6.435 -17.538 1.00 41.13 C ATOM 146 CD1 LEU A 13 11.136 -7.125 -16.660 1.00 10.53 C ATOM 147 CD2 LEU A 13 11.626 -5.114 -18.065 1.00 21.04 C ATOM 148 HA LEU A 13 13.448 -8.145 -15.828 1.00 0.00 H ATOM 149 HB2 LEU A 13 13.237 -5.596 -15.894 1.00 0.00 H ATOM 150 HB3 LEU A 13 14.156 -5.672 -17.416 1.00 0.00 H ATOM 151 HG LEU A 13 12.381 -7.082 -18.389 1.00 0.00 H ATOM 152 HD21 LEU A 13 11.429 -4.444 -17.228 1.00 0.00 H ATOM 153 HD22 LEU A 13 12.361 -4.661 -18.730 1.00 0.00 H ATOM 154 HD23 LEU A 13 10.701 -5.295 -18.613 1.00 0.00 H ATOM 155 HD11 LEU A 13 11.525 -8.090 -16.334 1.00 0.00 H ATOM 156 HD12 LEU A 13 10.927 -6.503 -15.790 1.00 0.00 H ATOM 157 HD13 LEU A 13 10.219 -7.275 -17.229 1.00 0.00 H ATOM 158 H LEU A 13 15.335 -6.126 -15.024 1.00 0.00 H ATOM 159 N ASP A 14 15.900 -7.572 -17.976 1.00 63.33 N ATOM 160 CA ASP A 14 16.631 -8.150 -19.099 1.00 13.14 C ATOM 161 C ASP A 14 17.059 -9.581 -18.789 1.00 44.12 C ATOM 162 O ASP A 14 16.792 -10.502 -19.561 1.00 55.44 O ATOM 163 CB ASP A 14 17.856 -7.297 -19.430 1.00 25.31 C ATOM 164 CG ASP A 14 17.484 -5.957 -20.032 1.00 52.13 C ATOM 165 OD1 ASP A 14 16.509 -5.907 -20.811 1.00 63.53 O ATOM 166 OD2 ASP A 14 18.167 -4.957 -19.725 1.00 62.54 O ATOM 167 HA ASP A 14 15.967 -8.168 -19.963 1.00 0.00 H ATOM 168 HB2 ASP A 14 18.420 -7.124 -18.514 1.00 0.00 H ATOM 169 HB3 ASP A 14 18.478 -7.840 -20.142 1.00 0.00 H ATOM 170 H ASP A 14 16.210 -6.659 -17.585 1.00 0.00 H ATOM 171 N LYS A 15 17.728 -9.761 -17.655 1.00 52.31 N ATOM 172 CA LYS A 15 18.194 -11.079 -17.242 1.00 44.11 C ATOM 173 C LYS A 15 17.019 -12.021 -17.001 1.00 63.24 C ATOM 174 O LYS A 15 17.065 -13.193 -17.375 1.00 22.21 O ATOM 175 CB LYS A 15 19.041 -10.968 -15.972 1.00 64.13 C ATOM 176 CG LYS A 15 20.516 -11.256 -16.197 1.00 74.15 C ATOM 177 CD LYS A 15 21.395 -10.385 -15.317 1.00 10.35 C ATOM 178 CE LYS A 15 22.860 -10.779 -15.427 1.00 52.14 C ATOM 179 NZ LYS A 15 23.736 -9.598 -15.664 1.00 14.11 N ATOM 180 HA LYS A 15 18.806 -11.489 -18.046 1.00 0.00 H ATOM 181 HB2 LYS A 15 18.943 -9.956 -15.580 1.00 0.00 H ATOM 182 HB3 LYS A 15 18.659 -11.679 -15.239 1.00 0.00 H ATOM 183 HG2 LYS A 15 20.712 -12.303 -15.967 1.00 0.00 H ATOM 184 HG3 LYS A 15 20.759 -11.063 -17.242 1.00 0.00 H ATOM 185 HD2 LYS A 15 21.284 -9.345 -15.624 1.00 0.00 H ATOM 186 HD3 LYS A 15 21.076 -10.493 -14.280 1.00 0.00 H ATOM 187 HE2 LYS A 15 22.976 -11.477 -16.256 1.00 0.00 H ATOM 188 HE3 LYS A 15 23.165 -11.264 -14.500 1.00 0.00 H ATOM 189 HZ1 LYS A 15 23.456 -9.132 -16.551 1.00 0.00 H ATOM 190 HZ2 LYS A 15 23.636 -8.930 -14.873 1.00 0.00 H ATOM 191 HZ3 LYS A 15 24.726 -9.910 -15.733 1.00 0.00 H ATOM 192 H LYS A 15 17.924 -8.941 -17.047 1.00 0.00 H ATOM 193 N TRP A 16 15.969 -11.501 -16.377 1.00 74.44 N ATOM 194 CA TRP A 16 14.781 -12.297 -16.089 1.00 13.13 C ATOM 195 C TRP A 16 14.236 -12.942 -17.358 1.00 53.02 C ATOM 196 O TRP A 16 14.048 -14.157 -17.415 1.00 55.45 O ATOM 197 CB TRP A 16 13.703 -11.426 -15.441 1.00 40.55 C ATOM 198 CG TRP A 16 12.405 -12.145 -15.230 1.00 42.11 C ATOM 199 CD1 TRP A 16 11.298 -12.089 -16.027 1.00 52.23 C ATOM 200 CD2 TRP A 16 12.080 -13.026 -14.150 1.00 22.42 C ATOM 201 NE1 TRP A 16 10.304 -12.882 -15.508 1.00 32.44 N ATOM 202 CE2 TRP A 16 10.759 -13.469 -14.357 1.00 30.23 C ATOM 203 CE3 TRP A 16 12.777 -13.487 -13.029 1.00 51.44 C ATOM 204 CZ2 TRP A 16 10.123 -14.348 -13.483 1.00 44.33 C ATOM 205 CZ3 TRP A 16 12.145 -14.358 -12.163 1.00 74.23 C ATOM 206 CH2 TRP A 16 10.829 -14.782 -12.394 1.00 61.03 C ATOM 207 HA TRP A 16 15.064 -13.088 -15.395 1.00 0.00 H ATOM 208 HB2 TRP A 16 14.070 -11.084 -14.473 1.00 0.00 H ATOM 209 HB3 TRP A 16 13.521 -10.565 -16.084 1.00 0.00 H ATOM 210 HE1 TRP A 16 9.359 -13.015 -15.922 1.00 0.00 H ATOM 211 HD1 TRP A 16 11.215 -11.501 -16.941 1.00 0.00 H ATOM 212 HZ2 TRP A 16 9.099 -14.678 -13.660 1.00 0.00 H ATOM 213 HH2 TRP A 16 10.359 -15.471 -11.692 1.00 0.00 H ATOM 214 HZ3 TRP A 16 12.679 -14.722 -11.285 1.00 0.00 H ATOM 215 HE3 TRP A 16 13.801 -13.165 -12.842 1.00 0.00 H ATOM 216 H TRP A 16 15.994 -10.503 -16.087 1.00 0.00 H ATOM 217 N GLU A 17 13.985 -12.121 -18.373 1.00 73.13 N ATOM 218 CA GLU A 17 13.461 -12.614 -19.642 1.00 15.14 C ATOM 219 C GLU A 17 14.403 -13.645 -20.256 1.00 32.11 C ATOM 220 O GLU A 17 13.980 -14.512 -21.022 1.00 11.45 O ATOM 221 CB GLU A 17 13.250 -11.454 -20.617 1.00 43.02 C ATOM 222 CG GLU A 17 11.969 -10.675 -20.370 1.00 61.52 C ATOM 223 CD GLU A 17 11.525 -9.883 -21.584 1.00 40.50 C ATOM 224 OE1 GLU A 17 12.401 -9.404 -22.334 1.00 23.11 O ATOM 225 OE2 GLU A 17 10.300 -9.741 -21.784 1.00 3.12 O ATOM 226 HA GLU A 17 12.502 -13.095 -19.448 1.00 0.00 H ATOM 227 HB2 GLU A 17 14.093 -10.769 -20.525 1.00 0.00 H ATOM 228 HB3 GLU A 17 13.219 -11.856 -21.630 1.00 0.00 H ATOM 229 HG2 GLU A 17 11.179 -11.377 -20.103 1.00 0.00 H ATOM 230 HG3 GLU A 17 12.134 -9.984 -19.543 1.00 0.00 H ATOM 231 H GLU A 17 14.166 -11.103 -18.260 1.00 0.00 H ATOM 232 N LYS A 18 15.683 -13.545 -19.915 1.00 42.21 N ATOM 233 CA LYS A 18 16.687 -14.468 -20.431 1.00 3.31 C ATOM 234 C LYS A 18 16.592 -15.821 -19.733 1.00 40.24 C ATOM 235 O LYS A 18 16.541 -16.864 -20.386 1.00 40.33 O ATOM 236 CB LYS A 18 18.090 -13.884 -20.245 1.00 54.22 C ATOM 237 CG LYS A 18 18.941 -13.934 -21.502 1.00 54.33 C ATOM 238 CD LYS A 18 19.997 -12.841 -21.505 1.00 34.15 C ATOM 239 CE LYS A 18 21.395 -13.417 -21.344 1.00 61.43 C ATOM 240 NZ LYS A 18 22.405 -12.645 -22.119 1.00 5.11 N ATOM 241 HA LYS A 18 16.498 -14.613 -21.495 1.00 0.00 H ATOM 242 HB2 LYS A 18 17.992 -12.843 -19.936 1.00 0.00 H ATOM 243 HB3 LYS A 18 18.597 -14.448 -19.462 1.00 0.00 H ATOM 244 HG2 LYS A 18 19.435 -14.904 -21.557 1.00 0.00 H ATOM 245 HG3 LYS A 18 18.296 -13.806 -22.372 1.00 0.00 H ATOM 246 HD2 LYS A 18 19.943 -12.299 -22.449 1.00 0.00 H ATOM 247 HD3 LYS A 18 19.799 -12.155 -20.682 1.00 0.00 H ATOM 248 HE2 LYS A 18 21.394 -14.449 -21.695 1.00 0.00 H ATOM 249 HE3 LYS A 18 21.667 -13.394 -20.289 1.00 0.00 H ATOM 250 HZ1 LYS A 18 22.157 -12.667 -23.129 1.00 0.00 H ATOM 251 HZ2 LYS A 18 22.417 -11.660 -21.786 1.00 0.00 H ATOM 252 HZ3 LYS A 18 23.344 -13.070 -21.982 1.00 0.00 H ATOM 253 H LYS A 18 15.976 -12.789 -19.264 1.00 0.00 H ATOM 254 N ILE A 19 16.567 -15.796 -18.405 1.00 61.22 N ATOM 255 CA ILE A 19 16.475 -17.021 -17.621 1.00 22.15 C ATOM 256 C ILE A 19 15.311 -17.888 -18.089 1.00 2.12 C ATOM 257 O ILE A 19 14.242 -17.380 -18.427 1.00 1.42 O ATOM 258 CB ILE A 19 16.303 -16.717 -16.120 1.00 62.35 C ATOM 259 CG1 ILE A 19 17.475 -15.876 -15.611 1.00 1.14 C ATOM 260 CG2 ILE A 19 16.188 -18.011 -15.328 1.00 3.32 C ATOM 261 CD1 ILE A 19 17.051 -14.714 -14.739 1.00 61.43 C ATOM 262 HA ILE A 19 17.410 -17.561 -17.770 1.00 0.00 H ATOM 263 HB ILE A 19 15.384 -16.147 -15.982 1.00 0.00 H ATOM 264 HG12 ILE A 19 18.136 -16.520 -15.031 1.00 0.00 H ATOM 265 HG13 ILE A 19 18.017 -15.482 -16.471 1.00 0.00 H ATOM 266 HD11 ILE A 19 16.398 -14.053 -15.309 1.00 0.00 H ATOM 267 HD12 ILE A 19 16.517 -15.092 -13.867 1.00 0.00 H ATOM 268 HD13 ILE A 19 17.934 -14.163 -14.415 1.00 0.00 H ATOM 269 HG21 ILE A 19 15.323 -18.574 -15.679 1.00 0.00 H ATOM 270 HG22 ILE A 19 17.092 -18.604 -15.470 1.00 0.00 H ATOM 271 HG23 ILE A 19 16.067 -17.778 -14.270 1.00 0.00 H ATOM 272 H ILE A 19 16.614 -14.881 -17.913 1.00 0.00 H ATOM 273 N ARG A 20 15.526 -19.199 -18.105 1.00 21.35 N ATOM 274 CA ARG A 20 14.495 -20.137 -18.531 1.00 33.54 C ATOM 275 C ARG A 20 13.892 -20.864 -17.332 1.00 31.11 C ATOM 276 O ARG A 20 14.521 -20.974 -16.279 1.00 31.54 O ATOM 277 CB ARG A 20 15.075 -21.153 -19.517 1.00 52.31 C ATOM 278 CG ARG A 20 15.458 -20.549 -20.858 1.00 54.43 C ATOM 279 CD ARG A 20 16.348 -21.487 -21.658 1.00 54.22 C ATOM 280 NE ARG A 20 16.900 -20.839 -22.845 1.00 14.42 N ATOM 281 CZ ARG A 20 17.607 -21.478 -23.770 1.00 32.23 C ATOM 282 NH1 ARG A 20 17.846 -22.776 -23.646 1.00 24.32 N ATOM 283 NH2 ARG A 20 18.076 -20.819 -24.822 1.00 34.14 N ATOM 284 HA ARG A 20 13.706 -19.570 -19.025 1.00 0.00 H ATOM 285 HB2 ARG A 20 15.966 -21.596 -19.071 1.00 0.00 H ATOM 286 HB3 ARG A 20 14.331 -21.931 -19.689 1.00 0.00 H ATOM 287 HG2 ARG A 20 14.551 -20.348 -21.428 1.00 0.00 H ATOM 288 HG3 ARG A 20 15.992 -19.614 -20.686 1.00 0.00 H ATOM 289 HD2 ARG A 20 15.760 -22.350 -21.970 1.00 0.00 H ATOM 290 HD3 ARG A 20 17.170 -21.819 -21.024 1.00 0.00 H ATOM 291 HE ARG A 20 16.730 -19.821 -22.973 1.00 0.00 H ATOM 292 HH12 ARG A 20 18.400 -23.274 -24.372 1.00 0.00 H ATOM 293 HH11 ARG A 20 17.480 -23.296 -22.823 1.00 0.00 H ATOM 294 HH22 ARG A 20 18.629 -21.321 -25.546 1.00 0.00 H ATOM 295 HH21 ARG A 20 17.890 -19.801 -24.923 1.00 0.00 H ATOM 296 H ARG A 20 16.453 -19.565 -17.806 1.00 0.00 H ATOM 297 N LEU A 21 12.670 -21.358 -17.499 1.00 50.51 N ATOM 298 CA LEU A 21 11.981 -22.074 -16.431 1.00 2.41 C ATOM 299 C LEU A 21 12.594 -23.454 -16.217 1.00 42.22 C ATOM 300 O LEU A 21 12.569 -23.990 -15.109 1.00 61.34 O ATOM 301 CB LEU A 21 10.493 -22.209 -16.758 1.00 60.10 C ATOM 302 CG LEU A 21 9.776 -20.922 -17.168 1.00 30.22 C ATOM 303 CD1 LEU A 21 8.830 -21.185 -18.329 1.00 41.23 C ATOM 304 CD2 LEU A 21 9.021 -20.333 -15.985 1.00 51.23 C ATOM 305 HA LEU A 21 12.094 -21.500 -15.511 1.00 0.00 H ATOM 306 HB2 LEU A 21 10.395 -22.921 -17.577 1.00 0.00 H ATOM 307 HB3 LEU A 21 9.992 -22.603 -15.874 1.00 0.00 H ATOM 308 HG LEU A 21 10.524 -20.199 -17.493 1.00 0.00 H ATOM 309 HD21 LEU A 21 8.283 -21.053 -15.632 1.00 0.00 H ATOM 310 HD22 LEU A 21 9.724 -20.108 -15.183 1.00 0.00 H ATOM 311 HD23 LEU A 21 8.517 -19.418 -16.296 1.00 0.00 H ATOM 312 HD11 LEU A 21 9.397 -21.561 -19.180 1.00 0.00 H ATOM 313 HD12 LEU A 21 8.087 -21.925 -18.030 1.00 0.00 H ATOM 314 HD13 LEU A 21 8.330 -20.257 -18.606 1.00 0.00 H ATOM 315 H LEU A 21 12.193 -21.231 -18.414 1.00 0.00 H ATOM 316 N ARG A 22 13.146 -24.022 -17.284 1.00 61.23 N ATOM 317 CA ARG A 22 13.767 -25.339 -17.213 1.00 72.52 C ATOM 318 C ARG A 22 15.048 -25.382 -18.041 1.00 72.21 C ATOM 319 O ARG A 22 15.235 -24.609 -18.981 1.00 32.30 O ATOM 320 CB ARG A 22 12.793 -26.413 -17.704 1.00 44.43 C ATOM 321 CG ARG A 22 12.074 -26.040 -18.991 1.00 5.04 C ATOM 322 CD ARG A 22 10.602 -25.751 -18.742 1.00 43.32 C ATOM 323 NE ARG A 22 9.765 -26.178 -19.860 1.00 15.25 N ATOM 324 CZ ARG A 22 9.413 -27.441 -20.074 1.00 44.10 C ATOM 325 NH1 ARG A 22 9.825 -28.396 -19.251 1.00 41.35 N ATOM 326 NH2 ARG A 22 8.648 -27.751 -21.113 1.00 3.21 N ATOM 327 HA ARG A 22 14.021 -25.537 -16.172 1.00 0.00 H ATOM 328 HB2 ARG A 22 13.352 -27.333 -17.875 1.00 0.00 H ATOM 329 HB3 ARG A 22 12.046 -26.582 -16.928 1.00 0.00 H ATOM 330 HG2 ARG A 22 12.543 -25.152 -19.415 1.00 0.00 H ATOM 331 HG3 ARG A 22 12.159 -26.866 -19.697 1.00 0.00 H ATOM 332 HD2 ARG A 22 10.473 -24.679 -18.595 1.00 0.00 H ATOM 333 HD3 ARG A 22 10.286 -26.280 -17.843 1.00 0.00 H ATOM 334 HE ARG A 22 9.426 -25.454 -20.525 1.00 0.00 H ATOM 335 HH12 ARG A 22 9.548 -29.384 -19.421 1.00 0.00 H ATOM 336 HH11 ARG A 22 10.425 -28.157 -18.436 1.00 0.00 H ATOM 337 HH22 ARG A 22 8.373 -28.740 -21.280 1.00 0.00 H ATOM 338 HH21 ARG A 22 8.323 -27.005 -21.761 1.00 0.00 H ATOM 339 H ARG A 22 13.135 -23.515 -18.192 1.00 0.00 H ATOM 340 N PRO A 23 15.952 -26.306 -17.685 1.00 23.41 N ATOM 341 CA PRO A 23 17.231 -26.472 -18.382 1.00 23.21 C ATOM 342 C PRO A 23 17.057 -27.042 -19.785 1.00 71.15 C ATOM 343 O PRO A 23 17.766 -26.658 -20.715 1.00 13.45 O ATOM 344 CB PRO A 23 17.993 -27.460 -17.495 1.00 3.34 C ATOM 345 CG PRO A 23 16.932 -28.224 -16.780 1.00 45.15 C ATOM 346 CD PRO A 23 15.796 -27.261 -16.575 1.00 31.13 C ATOM 347 HA PRO A 23 17.744 -25.521 -18.523 1.00 0.00 H ATOM 348 HD3 PRO A 23 14.835 -27.773 -16.633 1.00 0.00 H ATOM 349 HD2 PRO A 23 15.881 -26.757 -15.612 1.00 0.00 H ATOM 350 HG3 PRO A 23 17.304 -28.582 -15.820 1.00 0.00 H ATOM 351 HG2 PRO A 23 16.606 -29.073 -17.381 1.00 0.00 H ATOM 352 HB2 PRO A 23 18.605 -28.128 -18.101 1.00 0.00 H ATOM 353 HB3 PRO A 23 18.629 -26.929 -16.786 1.00 0.00 H ATOM 354 N GLY A 24 16.108 -27.962 -19.932 1.00 53.44 N ATOM 355 CA GLY A 24 15.857 -28.569 -21.226 1.00 64.24 C ATOM 356 C GLY A 24 14.509 -28.179 -21.799 1.00 43.11 C ATOM 357 O GLY A 24 13.676 -29.038 -22.084 1.00 40.24 O ATOM 358 HA3 GLY A 24 15.890 -29.653 -21.116 1.00 0.00 H ATOM 359 HA2 GLY A 24 16.637 -28.251 -21.918 1.00 0.00 H ATOM 360 H GLY A 24 15.539 -28.250 -19.110 1.00 0.00 H ATOM 361 N GLY A 25 14.293 -26.878 -21.967 1.00 2.44 N ATOM 362 CA GLY A 25 13.034 -26.398 -22.506 1.00 63.24 C ATOM 363 C GLY A 25 13.228 -25.430 -23.657 1.00 31.04 C ATOM 364 O GLY A 25 14.358 -25.139 -24.050 1.00 73.54 O ATOM 365 HA3 GLY A 25 12.483 -25.893 -21.713 1.00 0.00 H ATOM 366 HA2 GLY A 25 12.457 -27.252 -22.860 1.00 0.00 H ATOM 367 H GLY A 25 15.035 -26.196 -21.709 1.00 0.00 H ATOM 368 N LYS A 26 12.123 -24.930 -24.199 1.00 10.30 N ATOM 369 CA LYS A 26 12.175 -23.989 -25.312 1.00 14.24 C ATOM 370 C LYS A 26 11.403 -22.715 -24.983 1.00 10.30 C ATOM 371 O LYS A 26 10.883 -22.044 -25.875 1.00 2.42 O ATOM 372 CB LYS A 26 11.603 -24.632 -26.577 1.00 52.22 C ATOM 373 CG LYS A 26 12.186 -24.070 -27.862 1.00 4.21 C ATOM 374 CD LYS A 26 11.989 -25.023 -29.028 1.00 75.42 C ATOM 375 CE LYS A 26 13.120 -24.910 -30.039 1.00 33.42 C ATOM 376 NZ LYS A 26 14.016 -26.099 -30.003 1.00 71.14 N ATOM 377 HA LYS A 26 13.219 -23.726 -25.485 1.00 0.00 H ATOM 378 HB2 LYS A 26 11.809 -25.702 -26.544 1.00 0.00 H ATOM 379 HB3 LYS A 26 10.525 -24.471 -26.588 1.00 0.00 H ATOM 380 HG2 LYS A 26 11.694 -23.124 -28.090 1.00 0.00 H ATOM 381 HG3 LYS A 26 13.253 -23.898 -27.721 1.00 0.00 H ATOM 382 HD2 LYS A 26 11.954 -26.044 -28.649 1.00 0.00 H ATOM 383 HD3 LYS A 26 11.047 -24.788 -29.523 1.00 0.00 H ATOM 384 HE2 LYS A 26 13.707 -24.019 -29.814 1.00 0.00 H ATOM 385 HE3 LYS A 26 12.693 -24.820 -31.038 1.00 0.00 H ATOM 386 HZ1 LYS A 26 14.433 -26.189 -29.055 1.00 0.00 H ATOM 387 HZ2 LYS A 26 13.465 -26.953 -30.223 1.00 0.00 H ATOM 388 HZ3 LYS A 26 14.773 -25.982 -30.706 1.00 0.00 H ATOM 389 H LYS A 26 11.198 -25.217 -23.820 1.00 0.00 H ATOM 390 N LYS A 27 11.333 -22.386 -23.698 1.00 2.35 N ATOM 391 CA LYS A 27 10.628 -21.191 -23.250 1.00 53.54 C ATOM 392 C LYS A 27 11.411 -20.474 -22.155 1.00 44.25 C ATOM 393 O LYS A 27 12.043 -21.112 -21.313 1.00 55.24 O ATOM 394 CB LYS A 27 9.234 -21.558 -22.737 1.00 73.22 C ATOM 395 CG LYS A 27 8.254 -20.397 -22.752 1.00 63.32 C ATOM 396 CD LYS A 27 7.009 -20.708 -21.940 1.00 35.24 C ATOM 397 CE LYS A 27 5.743 -20.321 -22.689 1.00 60.13 C ATOM 398 NZ LYS A 27 4.637 -21.289 -22.448 1.00 64.00 N ATOM 399 HA LYS A 27 10.530 -20.518 -24.102 1.00 0.00 H ATOM 400 HB2 LYS A 27 8.834 -22.355 -23.365 1.00 0.00 H ATOM 401 HB3 LYS A 27 9.327 -21.917 -21.712 1.00 0.00 H ATOM 402 HG2 LYS A 27 8.741 -19.517 -22.331 1.00 0.00 H ATOM 403 HG3 LYS A 27 7.963 -20.192 -23.782 1.00 0.00 H ATOM 404 HD2 LYS A 27 6.982 -21.777 -21.728 1.00 0.00 H ATOM 405 HD3 LYS A 27 7.050 -20.153 -21.003 1.00 0.00 H ATOM 406 HE2 LYS A 27 5.960 -20.292 -23.757 1.00 0.00 H ATOM 407 HE3 LYS A 27 5.425 -19.333 -22.357 1.00 0.00 H ATOM 408 HZ1 LYS A 27 4.929 -22.234 -22.768 1.00 0.00 H ATOM 409 HZ2 LYS A 27 4.419 -21.318 -21.432 1.00 0.00 H ATOM 410 HZ3 LYS A 27 3.793 -20.988 -22.977 1.00 0.00 H ATOM 411 H LYS A 27 11.793 -22.997 -22.993 1.00 0.00 H ATOM 412 N GLN A 28 11.365 -19.146 -22.173 1.00 51.34 N ATOM 413 CA GLN A 28 12.070 -18.344 -21.181 1.00 4.41 C ATOM 414 C GLN A 28 11.106 -17.808 -20.128 1.00 33.30 C ATOM 415 O GLN A 28 9.918 -18.132 -20.138 1.00 53.34 O ATOM 416 CB GLN A 28 12.800 -17.182 -21.858 1.00 65.51 C ATOM 417 CG GLN A 28 13.561 -17.589 -23.110 1.00 24.34 C ATOM 418 CD GLN A 28 12.788 -17.304 -24.382 1.00 35.53 C ATOM 419 OE1 GLN A 28 12.360 -16.175 -24.622 1.00 34.20 O ATOM 420 NE2 GLN A 28 12.604 -18.330 -25.205 1.00 54.22 N ATOM 421 HA GLN A 28 12.800 -18.985 -20.687 1.00 0.00 H ATOM 422 HB2 GLN A 28 12.065 -16.425 -22.132 1.00 0.00 H ATOM 423 HB3 GLN A 28 13.508 -16.758 -21.146 1.00 0.00 H ATOM 424 HG2 GLN A 28 14.501 -17.038 -23.142 1.00 0.00 H ATOM 425 HG3 GLN A 28 13.769 -18.658 -23.060 1.00 0.00 H ATOM 426 HE22 GLN A 28 12.984 -19.267 -24.961 1.00 0.00 H ATOM 427 HE21 GLN A 28 12.080 -18.197 -26.093 1.00 0.00 H ATOM 428 H GLN A 28 10.813 -18.667 -22.913 1.00 0.00 H ATOM 429 N TYR A 29 11.624 -16.989 -19.220 1.00 40.32 N ATOM 430 CA TYR A 29 10.809 -16.411 -18.158 1.00 40.33 C ATOM 431 C TYR A 29 10.116 -15.138 -18.635 1.00 74.12 C ATOM 432 O TYR A 29 10.633 -14.417 -19.488 1.00 42.40 O ATOM 433 CB TYR A 29 11.672 -16.106 -16.933 1.00 2.12 C ATOM 434 CG TYR A 29 11.602 -17.171 -15.862 1.00 75.33 C ATOM 435 CD1 TYR A 29 10.508 -17.255 -15.009 1.00 72.13 C ATOM 436 CD2 TYR A 29 12.628 -18.093 -15.703 1.00 25.30 C ATOM 437 CE1 TYR A 29 10.439 -18.226 -14.029 1.00 60.33 C ATOM 438 CE2 TYR A 29 12.568 -19.069 -14.727 1.00 14.23 C ATOM 439 CZ TYR A 29 11.471 -19.131 -13.892 1.00 61.13 C ATOM 440 OH TYR A 29 11.407 -20.100 -12.918 1.00 23.44 O ATOM 441 HA TYR A 29 10.045 -17.139 -17.884 1.00 0.00 H ATOM 442 HB3 TYR A 29 11.338 -15.162 -16.503 1.00 0.00 H ATOM 443 HB2 TYR A 29 12.708 -16.010 -17.257 1.00 0.00 H ATOM 444 HD2 TYR A 29 13.496 -18.046 -16.360 1.00 0.00 H ATOM 445 HE2 TYR A 29 13.382 -19.786 -14.617 1.00 0.00 H ATOM 446 HE1 TYR A 29 9.574 -18.277 -13.368 1.00 0.00 H ATOM 447 HD1 TYR A 29 9.690 -16.542 -15.115 1.00 0.00 H ATOM 448 HH TYR A 29 11.439 -20.994 -13.341 1.00 0.00 H ATOM 449 H TYR A 29 12.636 -16.754 -19.268 1.00 0.00 H ATOM 450 N LYS A 30 8.940 -14.868 -18.078 1.00 21.44 N ATOM 451 CA LYS A 30 8.174 -13.683 -18.442 1.00 51.32 C ATOM 452 C LYS A 30 7.375 -13.163 -17.251 1.00 22.50 C ATOM 453 O LYS A 30 7.246 -13.845 -16.233 1.00 11.42 O ATOM 454 CB LYS A 30 7.230 -13.998 -19.604 1.00 55.05 C ATOM 455 CG LYS A 30 7.570 -13.254 -20.884 1.00 1.20 C ATOM 456 CD LYS A 30 6.700 -13.710 -22.043 1.00 61.21 C ATOM 457 CE LYS A 30 5.646 -12.671 -22.392 1.00 42.41 C ATOM 458 NZ LYS A 30 4.808 -12.313 -21.214 1.00 44.00 N ATOM 459 HA LYS A 30 8.876 -12.909 -18.751 1.00 0.00 H ATOM 460 HB2 LYS A 30 7.276 -15.068 -19.805 1.00 0.00 H ATOM 461 HB3 LYS A 30 6.216 -13.728 -19.307 1.00 0.00 H ATOM 462 HG2 LYS A 30 7.417 -12.187 -20.725 1.00 0.00 H ATOM 463 HG3 LYS A 30 8.615 -13.436 -21.133 1.00 0.00 H ATOM 464 HD2 LYS A 30 7.332 -13.881 -22.915 1.00 0.00 H ATOM 465 HD3 LYS A 30 6.203 -14.640 -21.768 1.00 0.00 H ATOM 466 HE2 LYS A 30 5.002 -13.071 -23.175 1.00 0.00 H ATOM 467 HE3 LYS A 30 6.144 -11.773 -22.757 1.00 0.00 H ATOM 468 HZ1 LYS A 30 4.324 -13.164 -20.863 1.00 0.00 H ATOM 469 HZ2 LYS A 30 5.414 -11.924 -20.464 1.00 0.00 H ATOM 470 HZ3 LYS A 30 4.103 -11.602 -21.495 1.00 0.00 H ATOM 471 H LYS A 30 8.556 -15.519 -17.364 1.00 0.00 H ATOM 472 N LEU A 31 6.840 -11.955 -17.385 1.00 1.01 N ATOM 473 CA LEU A 31 6.052 -11.345 -16.320 1.00 10.14 C ATOM 474 C LEU A 31 4.931 -12.276 -15.870 1.00 21.44 C ATOM 475 O LEU A 31 4.502 -12.238 -14.716 1.00 41.32 O ATOM 476 CB LEU A 31 5.465 -10.013 -16.791 1.00 64.11 C ATOM 477 CG LEU A 31 6.210 -8.755 -16.343 1.00 23.34 C ATOM 478 CD1 LEU A 31 7.585 -8.690 -16.989 1.00 24.31 C ATOM 479 CD2 LEU A 31 5.403 -7.510 -16.677 1.00 14.44 C ATOM 480 HA LEU A 31 6.712 -11.165 -15.472 1.00 0.00 H ATOM 481 HB2 LEU A 31 5.450 -10.022 -17.881 1.00 0.00 H ATOM 482 HB3 LEU A 31 4.444 -9.947 -16.416 1.00 0.00 H ATOM 483 HG LEU A 31 6.341 -8.800 -15.262 1.00 0.00 H ATOM 484 HD21 LEU A 31 5.241 -7.462 -17.754 1.00 0.00 H ATOM 485 HD22 LEU A 31 4.442 -7.554 -16.165 1.00 0.00 H ATOM 486 HD23 LEU A 31 5.950 -6.626 -16.350 1.00 0.00 H ATOM 487 HD11 LEU A 31 8.164 -9.567 -16.698 1.00 0.00 H ATOM 488 HD12 LEU A 31 7.475 -8.669 -18.073 1.00 0.00 H ATOM 489 HD13 LEU A 31 8.099 -7.788 -16.657 1.00 0.00 H ATOM 490 H LEU A 31 6.987 -11.431 -18.271 1.00 0.00 H ATOM 491 N LYS A 32 4.462 -13.115 -16.787 1.00 72.11 N ATOM 492 CA LYS A 32 3.393 -14.060 -16.485 1.00 62.13 C ATOM 493 C LYS A 32 3.724 -14.876 -15.240 1.00 0.14 C ATOM 494 O LYS A 32 2.835 -15.238 -14.468 1.00 70.45 O ATOM 495 CB LYS A 32 3.161 -14.996 -17.674 1.00 0.31 C ATOM 496 CG LYS A 32 1.699 -15.339 -17.902 1.00 10.45 C ATOM 497 CD LYS A 32 1.425 -16.811 -17.645 1.00 0.02 C ATOM 498 CE LYS A 32 -0.052 -17.066 -17.387 1.00 31.40 C ATOM 499 NZ LYS A 32 -0.717 -17.704 -18.557 1.00 12.01 N ATOM 500 HA LYS A 32 2.483 -13.492 -16.294 1.00 0.00 H ATOM 501 HB2 LYS A 32 3.546 -14.514 -18.573 1.00 0.00 H ATOM 502 HB3 LYS A 32 3.709 -15.922 -17.496 1.00 0.00 H ATOM 503 HG2 LYS A 32 1.086 -14.741 -17.228 1.00 0.00 H ATOM 504 HG3 LYS A 32 1.437 -15.105 -18.934 1.00 0.00 H ATOM 505 HD2 LYS A 32 1.737 -17.387 -18.516 1.00 0.00 H ATOM 506 HD3 LYS A 32 1.997 -17.131 -16.775 1.00 0.00 H ATOM 507 HE2 LYS A 32 -0.543 -16.116 -17.177 1.00 0.00 H ATOM 508 HE3 LYS A 32 -0.151 -17.723 -16.523 1.00 0.00 H ATOM 509 HZ1 LYS A 32 -0.633 -17.080 -19.385 1.00 0.00 H ATOM 510 HZ2 LYS A 32 -0.259 -18.615 -18.760 1.00 0.00 H ATOM 511 HZ3 LYS A 32 -1.722 -17.861 -18.340 1.00 0.00 H ATOM 512 H LYS A 32 4.867 -13.098 -17.745 1.00 0.00 H ATOM 513 N HIS A 33 5.008 -15.161 -15.048 1.00 3.40 N ATOM 514 CA HIS A 33 5.457 -15.932 -13.894 1.00 22.31 C ATOM 515 C HIS A 33 5.582 -15.041 -12.661 1.00 75.41 C ATOM 516 O HIS A 33 5.367 -15.560 -11.565 1.00 64.00 O ATOM 517 CB HIS A 33 6.800 -16.601 -14.191 1.00 51.32 C ATOM 518 CG HIS A 33 6.823 -17.347 -15.490 1.00 54.31 C ATOM 519 ND1 HIS A 33 7.684 -17.037 -16.521 1.00 23.21 N ATOM 520 CD2 HIS A 33 6.083 -18.395 -15.922 1.00 41.32 C ATOM 521 CE1 HIS A 33 7.473 -17.862 -17.531 1.00 20.01 C ATOM 522 NE2 HIS A 33 6.506 -18.696 -17.192 1.00 65.45 N ATOM 523 HA HIS A 33 4.713 -16.702 -13.691 1.00 0.00 H ATOM 524 HB2 HIS A 33 7.570 -15.830 -14.222 1.00 0.00 H ATOM 525 HB3 HIS A 33 7.022 -17.302 -13.386 1.00 0.00 H ATOM 526 HD2 HIS A 33 5.297 -18.905 -15.365 1.00 0.00 H ATOM 527 HE1 HIS A 33 8.006 -17.856 -18.482 1.00 0.00 H ATOM 528 H HIS A 33 5.710 -14.826 -15.738 1.00 0.00 H ATOM 529 N ILE A 34 5.910 -13.762 -12.805 1.00 12.11 N ATOM 530 CA ILE A 34 6.039 -12.873 -11.657 1.00 22.32 C ATOM 531 C ILE A 34 4.674 -12.529 -11.072 1.00 12.24 C ATOM 532 O ILE A 34 4.518 -12.415 -9.856 1.00 21.43 O ATOM 533 CB ILE A 34 6.768 -11.570 -12.033 1.00 54.52 C ATOM 534 CG1 ILE A 34 8.103 -11.883 -12.710 1.00 63.23 C ATOM 535 CG2 ILE A 34 6.983 -10.708 -10.798 1.00 50.42 C ATOM 536 CD1 ILE A 34 8.801 -10.661 -13.266 1.00 75.33 C ATOM 537 HA ILE A 34 6.627 -13.406 -10.910 1.00 0.00 H ATOM 538 HB ILE A 34 6.148 -11.014 -12.736 1.00 0.00 H ATOM 539 HG12 ILE A 34 8.760 -12.352 -11.977 1.00 0.00 H ATOM 540 HG13 ILE A 34 7.920 -12.578 -13.529 1.00 0.00 H ATOM 541 HD11 ILE A 34 8.161 -10.186 -14.010 1.00 0.00 H ATOM 542 HD12 ILE A 34 9.002 -9.959 -12.457 1.00 0.00 H ATOM 543 HD13 ILE A 34 9.740 -10.961 -13.731 1.00 0.00 H ATOM 544 HG21 ILE A 34 6.018 -10.461 -10.356 1.00 0.00 H ATOM 545 HG22 ILE A 34 7.585 -11.257 -10.074 1.00 0.00 H ATOM 546 HG23 ILE A 34 7.499 -9.791 -11.082 1.00 0.00 H ATOM 547 H ILE A 34 6.079 -13.386 -13.760 1.00 0.00 H ATOM 548 N VAL A 35 3.686 -12.365 -11.946 1.00 33.14 N ATOM 549 CA VAL A 35 2.332 -12.037 -11.516 1.00 53.40 C ATOM 550 C VAL A 35 1.612 -13.268 -10.977 1.00 4.35 C ATOM 551 O VAL A 35 0.906 -13.195 -9.971 1.00 71.31 O ATOM 552 CB VAL A 35 1.506 -11.438 -12.670 1.00 62.05 C ATOM 553 CG1 VAL A 35 0.089 -11.131 -12.211 1.00 3.34 C ATOM 554 CG2 VAL A 35 2.181 -10.189 -13.216 1.00 4.33 C ATOM 555 HA VAL A 35 2.424 -11.297 -10.721 1.00 0.00 H ATOM 556 HB VAL A 35 1.450 -12.173 -13.473 1.00 0.00 H ATOM 557 HG11 VAL A 35 -0.389 -12.050 -11.874 1.00 0.00 H ATOM 558 HG12 VAL A 35 0.122 -10.414 -11.390 1.00 0.00 H ATOM 559 HG13 VAL A 35 -0.477 -10.709 -13.041 1.00 0.00 H ATOM 560 HG21 VAL A 35 2.269 -9.448 -12.421 1.00 0.00 H ATOM 561 HG22 VAL A 35 3.173 -10.446 -13.586 1.00 0.00 H ATOM 562 HG23 VAL A 35 1.582 -9.781 -14.030 1.00 0.00 H ATOM 563 H VAL A 35 3.884 -12.473 -12.961 1.00 0.00 H ATOM 564 N TRP A 36 1.797 -14.397 -11.651 1.00 4.31 N ATOM 565 CA TRP A 36 1.166 -15.645 -11.239 1.00 30.23 C ATOM 566 C TRP A 36 1.590 -16.029 -9.825 1.00 61.04 C ATOM 567 O TRP A 36 0.750 -16.230 -8.949 1.00 23.23 O ATOM 568 CB TRP A 36 1.523 -16.768 -12.214 1.00 44.33 C ATOM 569 CG TRP A 36 1.018 -18.112 -11.784 1.00 52.45 C ATOM 570 CD1 TRP A 36 -0.237 -18.615 -11.977 1.00 60.22 C ATOM 571 CD2 TRP A 36 1.755 -19.122 -11.088 1.00 2.01 C ATOM 572 NE1 TRP A 36 -0.324 -19.878 -11.442 1.00 40.13 N ATOM 573 CE2 TRP A 36 0.885 -20.212 -10.892 1.00 31.22 C ATOM 574 CE3 TRP A 36 3.066 -19.213 -10.613 1.00 2.12 C ATOM 575 CZ2 TRP A 36 1.285 -21.376 -10.240 1.00 41.32 C ATOM 576 CZ3 TRP A 36 3.462 -20.368 -9.966 1.00 34.20 C ATOM 577 CH2 TRP A 36 2.574 -21.437 -9.785 1.00 61.41 C ATOM 578 HA TRP A 36 0.086 -15.496 -11.247 1.00 0.00 H ATOM 579 HB2 TRP A 36 1.092 -16.532 -13.187 1.00 0.00 H ATOM 580 HB3 TRP A 36 2.608 -16.818 -12.301 1.00 0.00 H ATOM 581 HE1 TRP A 36 -1.171 -20.482 -11.453 1.00 0.00 H ATOM 582 HD1 TRP A 36 -1.050 -18.092 -12.481 1.00 0.00 H ATOM 583 HZ2 TRP A 36 0.596 -22.208 -10.097 1.00 0.00 H ATOM 584 HH2 TRP A 36 2.917 -22.335 -9.271 1.00 0.00 H ATOM 585 HZ3 TRP A 36 4.482 -20.449 -9.590 1.00 0.00 H ATOM 586 HE3 TRP A 36 3.764 -18.387 -10.750 1.00 0.00 H ATOM 587 H TRP A 36 2.407 -14.391 -12.493 1.00 0.00 H ATOM 588 N ALA A 37 2.898 -16.129 -9.611 1.00 50.51 N ATOM 589 CA ALA A 37 3.433 -16.486 -8.303 1.00 73.01 C ATOM 590 C ALA A 37 2.944 -15.521 -7.228 1.00 21.30 C ATOM 591 O ALA A 37 2.870 -15.874 -6.051 1.00 72.41 O ATOM 592 CB ALA A 37 4.954 -16.509 -8.343 1.00 15.30 C ATOM 593 HA ALA A 37 3.072 -17.483 -8.050 1.00 0.00 H ATOM 594 HB1 ALA A 37 5.286 -17.244 -9.077 1.00 0.00 H ATOM 595 HB2 ALA A 37 5.324 -15.522 -8.622 1.00 0.00 H ATOM 596 HB3 ALA A 37 5.338 -16.777 -7.359 1.00 0.00 H ATOM 597 H ALA A 37 3.556 -15.948 -10.396 1.00 0.00 H ATOM 598 N SER A 38 2.613 -14.302 -7.640 1.00 13.21 N ATOM 599 CA SER A 38 2.135 -13.284 -6.711 1.00 25.43 C ATOM 600 C SER A 38 0.765 -13.658 -6.153 1.00 43.10 C ATOM 601 O SER A 38 0.506 -13.503 -4.960 1.00 34.44 O ATOM 602 CB SER A 38 2.062 -11.923 -7.405 1.00 62.22 C ATOM 603 OG SER A 38 2.997 -11.016 -6.848 1.00 41.42 O ATOM 604 HA SER A 38 2.841 -13.223 -5.883 1.00 0.00 H ATOM 605 HB2 SER A 38 1.058 -11.516 -7.287 1.00 0.00 H ATOM 606 HB3 SER A 38 2.279 -12.052 -8.465 1.00 0.00 H ATOM 607 HG SER A 38 2.929 -10.145 -7.314 1.00 0.00 H ATOM 608 H SER A 38 2.697 -14.068 -8.650 1.00 0.00 H ATOM 609 N ARG A 39 -0.108 -14.150 -7.026 1.00 24.11 N ATOM 610 CA ARG A 39 -1.452 -14.545 -6.622 1.00 42.23 C ATOM 611 C ARG A 39 -1.413 -15.801 -5.757 1.00 3.34 C ATOM 612 O ARG A 39 -2.140 -15.908 -4.770 1.00 74.31 O ATOM 613 CB ARG A 39 -2.326 -14.788 -7.854 1.00 32.42 C ATOM 614 CG ARG A 39 -2.957 -13.524 -8.412 1.00 54.53 C ATOM 615 CD ARG A 39 -2.615 -13.332 -9.882 1.00 21.05 C ATOM 616 NE ARG A 39 -2.824 -11.954 -10.317 1.00 52.12 N ATOM 617 CZ ARG A 39 -4.024 -11.418 -10.509 1.00 15.14 C ATOM 618 NH1 ARG A 39 -5.117 -12.140 -10.303 1.00 71.33 N ATOM 619 NH2 ARG A 39 -4.133 -10.156 -10.906 1.00 35.53 N ATOM 620 HA ARG A 39 -1.881 -13.734 -6.034 1.00 0.00 H ATOM 621 HB2 ARG A 39 -1.708 -15.237 -8.632 1.00 0.00 H ATOM 622 HB3 ARG A 39 -3.123 -15.479 -7.580 1.00 0.00 H ATOM 623 HG2 ARG A 39 -4.040 -13.592 -8.306 1.00 0.00 H ATOM 624 HG3 ARG A 39 -2.591 -12.666 -7.848 1.00 0.00 H ATOM 625 HD2 ARG A 39 -3.247 -13.989 -10.479 1.00 0.00 H ATOM 626 HD3 ARG A 39 -1.569 -13.596 -10.038 1.00 0.00 H ATOM 627 HE ARG A 39 -1.987 -11.360 -10.486 1.00 0.00 H ATOM 628 HH12 ARG A 39 -6.055 -11.718 -10.454 1.00 0.00 H ATOM 629 HH11 ARG A 39 -5.036 -13.129 -9.990 1.00 0.00 H ATOM 630 HH22 ARG A 39 -5.073 -9.737 -11.056 1.00 0.00 H ATOM 631 HH21 ARG A 39 -3.278 -9.586 -11.067 1.00 0.00 H ATOM 632 H ARG A 39 0.174 -14.256 -8.021 1.00 0.00 H ATOM 633 N GLU A 40 -0.559 -16.747 -6.134 1.00 21.21 N ATOM 634 CA GLU A 40 -0.427 -17.996 -5.392 1.00 42.32 C ATOM 635 C GLU A 40 0.249 -17.759 -4.045 1.00 31.05 C ATOM 636 O GLU A 40 0.045 -18.515 -3.094 1.00 21.13 O ATOM 637 CB GLU A 40 0.374 -19.015 -6.205 1.00 24.13 C ATOM 638 CG GLU A 40 -0.248 -20.401 -6.226 1.00 12.00 C ATOM 639 CD GLU A 40 -1.555 -20.442 -6.993 1.00 54.44 C ATOM 640 OE1 GLU A 40 -1.608 -19.880 -8.107 1.00 41.23 O ATOM 641 OE2 GLU A 40 -2.526 -21.036 -6.479 1.00 52.13 O ATOM 642 HA GLU A 40 -1.427 -18.390 -5.213 1.00 0.00 H ATOM 643 HB2 GLU A 40 0.449 -18.655 -7.231 1.00 0.00 H ATOM 644 HB3 GLU A 40 1.372 -19.092 -5.774 1.00 0.00 H ATOM 645 HG2 GLU A 40 0.453 -21.092 -6.694 1.00 0.00 H ATOM 646 HG3 GLU A 40 -0.435 -20.715 -5.199 1.00 0.00 H ATOM 647 H GLU A 40 0.029 -16.593 -6.978 1.00 0.00 H ATOM 648 N LEU A 41 1.054 -16.705 -3.970 1.00 62.23 N ATOM 649 CA LEU A 41 1.761 -16.368 -2.740 1.00 3.23 C ATOM 650 C LEU A 41 0.787 -15.902 -1.662 1.00 63.12 C ATOM 651 O LEU A 41 0.756 -16.452 -0.562 1.00 1.44 O ATOM 652 CB LEU A 41 2.802 -15.279 -3.008 1.00 55.21 C ATOM 653 CG LEU A 41 4.230 -15.763 -3.259 1.00 42.53 C ATOM 654 CD1 LEU A 41 5.147 -14.587 -3.560 1.00 54.23 C ATOM 655 CD2 LEU A 41 4.745 -16.550 -2.063 1.00 12.42 C ATOM 656 HA LEU A 41 2.267 -17.265 -2.384 1.00 0.00 H ATOM 657 HB2 LEU A 41 2.480 -14.719 -3.886 1.00 0.00 H ATOM 658 HB3 LEU A 41 2.822 -14.616 -2.143 1.00 0.00 H ATOM 659 HG LEU A 41 4.222 -16.423 -4.126 1.00 0.00 H ATOM 660 HD21 LEU A 41 4.737 -15.912 -1.179 1.00 0.00 H ATOM 661 HD22 LEU A 41 4.102 -17.414 -1.894 1.00 0.00 H ATOM 662 HD23 LEU A 41 5.763 -16.886 -2.262 1.00 0.00 H ATOM 663 HD11 LEU A 41 4.788 -14.066 -4.448 1.00 0.00 H ATOM 664 HD12 LEU A 41 5.149 -13.903 -2.711 1.00 0.00 H ATOM 665 HD13 LEU A 41 6.159 -14.953 -3.736 1.00 0.00 H ATOM 666 H LEU A 41 1.183 -16.105 -4.810 1.00 0.00 H ATOM 667 N GLU A 42 -0.007 -14.887 -1.988 1.00 72.43 N ATOM 668 CA GLU A 42 -0.983 -14.350 -1.048 1.00 12.51 C ATOM 669 C GLU A 42 -1.903 -15.451 -0.529 1.00 52.11 C ATOM 670 O GLU A 42 -2.437 -15.359 0.576 1.00 12.23 O ATOM 671 CB GLU A 42 -1.812 -13.249 -1.713 1.00 11.42 C ATOM 672 CG GLU A 42 -2.990 -12.783 -0.874 1.00 35.31 C ATOM 673 CD GLU A 42 -2.592 -12.428 0.545 1.00 11.23 C ATOM 674 OE1 GLU A 42 -1.458 -11.943 0.740 1.00 20.11 O ATOM 675 OE2 GLU A 42 -3.415 -12.635 1.461 1.00 15.54 O ATOM 676 HA GLU A 42 -0.440 -13.927 -0.203 1.00 0.00 H ATOM 677 HB2 GLU A 42 -1.162 -12.394 -1.900 1.00 0.00 H ATOM 678 HB3 GLU A 42 -2.193 -13.629 -2.661 1.00 0.00 H ATOM 679 HG2 GLU A 42 -3.427 -11.903 -1.345 1.00 0.00 H ATOM 680 HG3 GLU A 42 -3.732 -13.581 -0.839 1.00 0.00 H ATOM 681 H GLU A 42 0.070 -14.466 -2.936 1.00 0.00 H ATOM 682 N ARG A 43 -2.084 -16.492 -1.336 1.00 2.33 N ATOM 683 CA ARG A 43 -2.940 -17.610 -0.960 1.00 32.02 C ATOM 684 C ARG A 43 -2.334 -18.393 0.201 1.00 11.45 C ATOM 685 O ARG A 43 -3.052 -18.992 1.002 1.00 73.22 O ATOM 686 CB ARG A 43 -3.157 -18.538 -2.156 1.00 73.42 C ATOM 687 CG ARG A 43 -4.494 -19.261 -2.132 1.00 14.22 C ATOM 688 CD ARG A 43 -4.317 -20.766 -2.254 1.00 24.10 C ATOM 689 NE ARG A 43 -5.580 -21.481 -2.096 1.00 31.14 N ATOM 690 CZ ARG A 43 -5.669 -22.802 -1.991 1.00 22.30 C ATOM 691 NH1 ARG A 43 -4.573 -23.548 -2.027 1.00 74.52 N ATOM 692 NH2 ARG A 43 -6.855 -23.380 -1.849 1.00 50.22 N ATOM 693 HA ARG A 43 -3.902 -17.207 -0.641 1.00 0.00 H ATOM 694 HB2 ARG A 43 -3.103 -17.943 -3.068 1.00 0.00 H ATOM 695 HB3 ARG A 43 -2.362 -19.284 -2.162 1.00 0.00 H ATOM 696 HG2 ARG A 43 -5.000 -19.039 -1.193 1.00 0.00 H ATOM 697 HG3 ARG A 43 -5.103 -18.907 -2.964 1.00 0.00 H ATOM 698 HD2 ARG A 43 -3.623 -21.102 -1.483 1.00 0.00 H ATOM 699 HD3 ARG A 43 -3.904 -20.993 -3.237 1.00 0.00 H ATOM 700 HE ARG A 43 -6.458 -20.925 -2.064 1.00 0.00 H ATOM 701 HH12 ARG A 43 -4.645 -24.582 -1.945 1.00 0.00 H ATOM 702 HH11 ARG A 43 -3.642 -23.099 -2.138 1.00 0.00 H ATOM 703 HH22 ARG A 43 -6.923 -24.415 -1.767 1.00 0.00 H ATOM 704 HH21 ARG A 43 -7.717 -22.798 -1.820 1.00 0.00 H ATOM 705 H ARG A 43 -1.603 -16.509 -2.258 1.00 0.00 H ATOM 706 N PHE A 44 -1.008 -18.383 0.287 1.00 40.43 N ATOM 707 CA PHE A 44 -0.305 -19.092 1.349 1.00 62.51 C ATOM 708 C PHE A 44 0.027 -18.152 2.504 1.00 65.31 C ATOM 709 O PHE A 44 1.003 -18.359 3.225 1.00 0.51 O ATOM 710 CB PHE A 44 0.978 -19.725 0.806 1.00 3.00 C ATOM 711 CG PHE A 44 0.731 -20.810 -0.202 1.00 64.43 C ATOM 712 CD1 PHE A 44 0.060 -21.968 0.157 1.00 70.04 C ATOM 713 CD2 PHE A 44 1.171 -20.673 -1.509 1.00 63.31 C ATOM 714 CE1 PHE A 44 -0.169 -22.969 -0.769 1.00 12.30 C ATOM 715 CE2 PHE A 44 0.945 -21.670 -2.439 1.00 33.30 C ATOM 716 CZ PHE A 44 0.275 -22.820 -2.068 1.00 53.13 C ATOM 717 HA PHE A 44 -0.961 -19.879 1.722 1.00 0.00 H ATOM 718 HB2 PHE A 44 1.575 -18.945 0.334 1.00 0.00 H ATOM 719 HB3 PHE A 44 1.534 -20.150 1.642 1.00 0.00 H ATOM 720 HD2 PHE A 44 1.701 -19.769 -1.807 1.00 0.00 H ATOM 721 HE2 PHE A 44 1.295 -21.549 -3.464 1.00 0.00 H ATOM 722 HZ PHE A 44 0.097 -23.608 -2.799 1.00 0.00 H ATOM 723 HE1 PHE A 44 -0.699 -23.874 -0.474 1.00 0.00 H ATOM 724 HD1 PHE A 44 -0.291 -22.091 1.181 1.00 0.00 H ATOM 725 H PHE A 44 -0.458 -17.856 -0.421 1.00 0.00 H ATOM 726 N ALA A 45 -0.791 -17.119 2.672 1.00 11.11 N ATOM 727 CA ALA A 45 -0.586 -16.148 3.739 1.00 1.43 C ATOM 728 C ALA A 45 0.724 -15.391 3.549 1.00 64.13 C ATOM 729 O ALA A 45 1.276 -14.836 4.499 1.00 43.23 O ATOM 730 CB ALA A 45 -0.606 -16.840 5.094 1.00 4.10 C ATOM 731 HA ALA A 45 -1.401 -15.426 3.700 1.00 0.00 H ATOM 732 HB1 ALA A 45 -1.570 -17.328 5.237 1.00 0.00 H ATOM 733 HB2 ALA A 45 0.189 -17.585 5.132 1.00 0.00 H ATOM 734 HB3 ALA A 45 -0.452 -16.101 5.880 1.00 0.00 H ATOM 735 H ALA A 45 -1.598 -17.000 2.026 1.00 0.00 H ATOM 736 N VAL A 46 1.218 -15.374 2.315 1.00 42.34 N ATOM 737 CA VAL A 46 2.464 -14.685 1.999 1.00 10.13 C ATOM 738 C VAL A 46 2.231 -13.560 0.997 1.00 65.11 C ATOM 739 O VAL A 46 1.859 -13.804 -0.150 1.00 32.22 O ATOM 740 CB VAL A 46 3.514 -15.657 1.429 1.00 0.12 C ATOM 741 CG1 VAL A 46 4.791 -14.913 1.070 1.00 3.03 C ATOM 742 CG2 VAL A 46 3.799 -16.774 2.421 1.00 30.42 C ATOM 743 HA VAL A 46 2.839 -14.264 2.932 1.00 0.00 H ATOM 744 HB VAL A 46 3.114 -16.104 0.519 1.00 0.00 H ATOM 745 HG11 VAL A 46 4.569 -14.153 0.321 1.00 0.00 H ATOM 746 HG12 VAL A 46 5.196 -14.438 1.963 1.00 0.00 H ATOM 747 HG13 VAL A 46 5.520 -15.617 0.669 1.00 0.00 H ATOM 748 HG21 VAL A 46 4.178 -16.346 3.349 1.00 0.00 H ATOM 749 HG22 VAL A 46 2.879 -17.323 2.622 1.00 0.00 H ATOM 750 HG23 VAL A 46 4.543 -17.451 2.001 1.00 0.00 H ATOM 751 H VAL A 46 0.703 -15.864 1.556 1.00 0.00 H ATOM 752 N ASN A 47 2.455 -12.326 1.438 1.00 72.31 N ATOM 753 CA ASN A 47 2.270 -11.162 0.579 1.00 75.41 C ATOM 754 C ASN A 47 3.224 -11.207 -0.611 1.00 12.13 C ATOM 755 O ASN A 47 4.362 -11.665 -0.509 1.00 31.24 O ATOM 756 CB ASN A 47 2.489 -9.875 1.375 1.00 2.43 C ATOM 757 CG ASN A 47 1.615 -9.804 2.612 1.00 11.34 C ATOM 758 OD1 ASN A 47 1.850 -10.509 3.594 1.00 42.23 O ATOM 759 ND2 ASN A 47 0.599 -8.950 2.570 1.00 11.54 N ATOM 760 HA ASN A 47 1.247 -11.178 0.202 1.00 0.00 H ATOM 761 HB2 ASN A 47 3.534 -9.826 1.681 1.00 0.00 H ATOM 762 HB3 ASN A 47 2.259 -9.024 0.734 1.00 0.00 H ATOM 763 HD22 ASN A 47 0.438 -8.374 1.719 1.00 0.00 H ATOM 764 HD21 ASN A 47 -0.036 -8.857 3.388 1.00 0.00 H ATOM 765 H ASN A 47 2.770 -12.187 2.419 1.00 0.00 H ATOM 766 N PRO A 48 2.751 -10.719 -1.767 1.00 51.12 N ATOM 767 CA PRO A 48 3.546 -10.691 -2.998 1.00 51.54 C ATOM 768 C PRO A 48 4.689 -9.683 -2.928 1.00 34.34 C ATOM 769 O PRO A 48 5.595 -9.699 -3.759 1.00 24.22 O ATOM 770 CB PRO A 48 2.531 -10.274 -4.066 1.00 43.22 C ATOM 771 CG PRO A 48 1.485 -9.519 -3.321 1.00 4.11 C ATOM 772 CD PRO A 48 1.404 -10.157 -1.962 1.00 12.24 C ATOM 773 HA PRO A 48 4.025 -11.650 -3.196 1.00 0.00 H ATOM 774 HD3 PRO A 48 1.176 -9.416 -1.196 1.00 0.00 H ATOM 775 HD2 PRO A 48 0.647 -10.941 -1.944 1.00 0.00 H ATOM 776 HG3 PRO A 48 0.526 -9.594 -3.833 1.00 0.00 H ATOM 777 HG2 PRO A 48 1.766 -8.470 -3.231 1.00 0.00 H ATOM 778 HB2 PRO A 48 3.002 -9.640 -4.817 1.00 0.00 H ATOM 779 HB3 PRO A 48 2.101 -11.150 -4.551 1.00 0.00 H ATOM 780 N GLY A 49 4.639 -8.808 -1.928 1.00 54.53 N ATOM 781 CA GLY A 49 5.676 -7.805 -1.768 1.00 31.44 C ATOM 782 C GLY A 49 7.025 -8.415 -1.440 1.00 13.51 C ATOM 783 O GLY A 49 8.058 -7.754 -1.558 1.00 72.21 O ATOM 784 HA3 GLY A 49 5.390 -7.132 -0.960 1.00 0.00 H ATOM 785 HA2 GLY A 49 5.763 -7.240 -2.696 1.00 0.00 H ATOM 786 H GLY A 49 3.848 -8.843 -1.253 1.00 0.00 H ATOM 787 N LEU A 50 7.017 -9.677 -1.025 1.00 50.44 N ATOM 788 CA LEU A 50 8.250 -10.375 -0.678 1.00 35.15 C ATOM 789 C LEU A 50 9.038 -10.745 -1.930 1.00 33.31 C ATOM 790 O LEU A 50 10.253 -10.936 -1.878 1.00 25.35 O ATOM 791 CB LEU A 50 7.934 -11.635 0.131 1.00 3.43 C ATOM 792 CG LEU A 50 7.078 -11.432 1.382 1.00 73.43 C ATOM 793 CD1 LEU A 50 6.898 -12.748 2.124 1.00 51.50 C ATOM 794 CD2 LEU A 50 7.702 -10.385 2.292 1.00 30.02 C ATOM 795 HA LEU A 50 8.860 -9.705 -0.073 1.00 0.00 H ATOM 796 HB2 LEU A 50 7.408 -12.329 -0.524 1.00 0.00 H ATOM 797 HB3 LEU A 50 8.880 -12.078 0.442 1.00 0.00 H ATOM 798 HG LEU A 50 6.096 -11.075 1.073 1.00 0.00 H ATOM 799 HD21 LEU A 50 8.697 -10.713 2.593 1.00 0.00 H ATOM 800 HD22 LEU A 50 7.777 -9.438 1.757 1.00 0.00 H ATOM 801 HD23 LEU A 50 7.078 -10.255 3.176 1.00 0.00 H ATOM 802 HD11 LEU A 50 6.405 -13.468 1.470 1.00 0.00 H ATOM 803 HD12 LEU A 50 7.874 -13.133 2.421 1.00 0.00 H ATOM 804 HD13 LEU A 50 6.286 -12.583 3.011 1.00 0.00 H ATOM 805 H LEU A 50 6.110 -10.179 -0.946 1.00 0.00 H ATOM 806 N LEU A 51 8.339 -10.843 -3.055 1.00 55.01 N ATOM 807 CA LEU A 51 8.973 -11.188 -4.323 1.00 1.13 C ATOM 808 C LEU A 51 9.977 -10.117 -4.738 1.00 74.14 C ATOM 809 O LEU A 51 10.913 -10.389 -5.489 1.00 71.10 O ATOM 810 CB LEU A 51 7.916 -11.363 -5.414 1.00 35.11 C ATOM 811 CG LEU A 51 6.943 -12.528 -5.225 1.00 62.05 C ATOM 812 CD1 LEU A 51 5.779 -12.414 -6.197 1.00 61.35 C ATOM 813 CD2 LEU A 51 7.662 -13.857 -5.405 1.00 22.23 C ATOM 814 HA LEU A 51 9.507 -12.129 -4.190 1.00 0.00 H ATOM 815 HB2 LEU A 51 7.331 -10.444 -5.462 1.00 0.00 H ATOM 816 HB3 LEU A 51 8.435 -11.512 -6.361 1.00 0.00 H ATOM 817 HG LEU A 51 6.548 -12.486 -4.210 1.00 0.00 H ATOM 818 HD21 LEU A 51 8.085 -13.907 -6.408 1.00 0.00 H ATOM 819 HD22 LEU A 51 8.461 -13.939 -4.668 1.00 0.00 H ATOM 820 HD23 LEU A 51 6.953 -14.674 -5.267 1.00 0.00 H ATOM 821 HD11 LEU A 51 5.250 -11.478 -6.020 1.00 0.00 H ATOM 822 HD12 LEU A 51 6.158 -12.431 -7.219 1.00 0.00 H ATOM 823 HD13 LEU A 51 5.098 -13.252 -6.047 1.00 0.00 H ATOM 824 H LEU A 51 7.314 -10.669 -3.032 1.00 0.00 H ATOM 825 N GLU A 52 9.775 -8.900 -4.243 1.00 51.12 N ATOM 826 CA GLU A 52 10.664 -7.789 -4.563 1.00 14.01 C ATOM 827 C GLU A 52 11.645 -7.532 -3.423 1.00 12.22 C ATOM 828 O GLU A 52 12.143 -6.418 -3.256 1.00 24.20 O ATOM 829 CB GLU A 52 9.852 -6.523 -4.847 1.00 63.33 C ATOM 830 CG GLU A 52 9.071 -6.018 -3.646 1.00 30.31 C ATOM 831 CD GLU A 52 8.687 -4.557 -3.772 1.00 54.13 C ATOM 832 OE1 GLU A 52 7.616 -4.274 -4.349 1.00 53.41 O ATOM 833 OE2 GLU A 52 9.456 -3.697 -3.295 1.00 61.11 O ATOM 834 HA GLU A 52 11.231 -8.056 -5.455 1.00 0.00 H ATOM 835 HB2 GLU A 52 10.538 -5.738 -5.167 1.00 0.00 H ATOM 836 HB3 GLU A 52 9.148 -6.738 -5.650 1.00 0.00 H ATOM 837 HG2 GLU A 52 8.162 -6.611 -3.546 1.00 0.00 H ATOM 838 HG3 GLU A 52 9.684 -6.142 -2.753 1.00 0.00 H ATOM 839 H GLU A 52 8.964 -8.736 -3.613 1.00 0.00 H ATOM 840 N THR A 53 11.918 -8.570 -2.639 1.00 33.40 N ATOM 841 CA THR A 53 12.837 -8.458 -1.514 1.00 30.03 C ATOM 842 C THR A 53 13.801 -9.638 -1.471 1.00 34.51 C ATOM 843 O THR A 53 13.380 -10.794 -1.418 1.00 34.03 O ATOM 844 CB THR A 53 12.079 -8.380 -0.175 1.00 3.31 C ATOM 845 OG1 THR A 53 11.546 -9.665 0.162 1.00 75.01 O ATOM 846 CG2 THR A 53 10.952 -7.361 -0.250 1.00 3.32 C ATOM 847 HA THR A 53 13.401 -7.537 -1.658 1.00 0.00 H ATOM 848 HB THR A 53 12.781 -8.065 0.597 1.00 0.00 H ATOM 849 HG1 THR A 53 10.923 -9.959 -0.549 1.00 0.00 H ATOM 850 HG23 THR A 53 11.363 -6.385 -0.507 1.00 0.00 H ATOM 851 HG21 THR A 53 10.237 -7.668 -1.013 1.00 0.00 H ATOM 852 HG22 THR A 53 10.451 -7.303 0.716 1.00 0.00 H ATOM 853 H THR A 53 11.464 -9.485 -2.834 1.00 0.00 H ATOM 854 N SER A 54 15.096 -9.340 -1.494 1.00 33.42 N ATOM 855 CA SER A 54 16.120 -10.378 -1.461 1.00 34.14 C ATOM 856 C SER A 54 15.969 -11.250 -0.218 1.00 22.31 C ATOM 857 O SER A 54 16.419 -12.395 -0.192 1.00 65.15 O ATOM 858 CB SER A 54 17.514 -9.749 -1.491 1.00 21.54 C ATOM 859 OG SER A 54 17.439 -8.337 -1.397 1.00 60.50 O ATOM 860 HA SER A 54 15.994 -11.007 -2.342 1.00 0.00 H ATOM 861 HB2 SER A 54 18.006 -10.018 -2.426 1.00 0.00 H ATOM 862 HB3 SER A 54 18.096 -10.131 -0.652 1.00 0.00 H ATOM 863 HG SER A 54 18.353 -7.957 -1.419 1.00 0.00 H ATOM 864 H SER A 54 15.386 -8.342 -1.537 1.00 0.00 H ATOM 865 N GLU A 55 15.333 -10.699 0.811 1.00 75.02 N ATOM 866 CA GLU A 55 15.123 -11.426 2.057 1.00 23.23 C ATOM 867 C GLU A 55 13.880 -12.307 1.971 1.00 1.13 C ATOM 868 O GLU A 55 13.915 -13.485 2.325 1.00 52.22 O ATOM 869 CB GLU A 55 14.990 -10.449 3.227 1.00 33.13 C ATOM 870 CG GLU A 55 16.322 -9.928 3.740 1.00 34.25 C ATOM 871 CD GLU A 55 16.371 -9.845 5.254 1.00 43.53 C ATOM 872 OE1 GLU A 55 16.279 -10.904 5.909 1.00 3.31 O ATOM 873 OE2 GLU A 55 16.502 -8.721 5.782 1.00 12.14 O ATOM 874 HA GLU A 55 15.989 -12.066 2.224 1.00 0.00 H ATOM 875 HB2 GLU A 55 14.390 -9.599 2.900 1.00 0.00 H ATOM 876 HB3 GLU A 55 14.481 -10.958 4.045 1.00 0.00 H ATOM 877 HG2 GLU A 55 17.113 -10.597 3.401 1.00 0.00 H ATOM 878 HG3 GLU A 55 16.489 -8.932 3.330 1.00 0.00 H ATOM 879 H GLU A 55 14.977 -9.726 0.725 1.00 0.00 H ATOM 880 N GLY A 56 12.781 -11.726 1.499 1.00 45.40 N ATOM 881 CA GLY A 56 11.542 -12.471 1.375 1.00 4.25 C ATOM 882 C GLY A 56 11.670 -13.658 0.441 1.00 4.24 C ATOM 883 O GLY A 56 11.283 -14.774 0.789 1.00 62.21 O ATOM 884 HA3 GLY A 56 10.770 -11.805 0.990 1.00 0.00 H ATOM 885 HA2 GLY A 56 11.250 -12.832 2.361 1.00 0.00 H ATOM 886 H GLY A 56 12.810 -10.726 1.215 1.00 0.00 H ATOM 887 N CYS A 57 12.213 -13.417 -0.747 1.00 31.41 N ATOM 888 CA CYS A 57 12.389 -14.476 -1.735 1.00 55.44 C ATOM 889 C CYS A 57 13.119 -15.669 -1.130 1.00 23.51 C ATOM 890 O CYS A 57 12.881 -16.815 -1.512 1.00 71.14 O ATOM 891 CB CYS A 57 13.162 -13.949 -2.945 1.00 51.31 C ATOM 892 SG CYS A 57 12.172 -13.813 -4.452 1.00 50.11 S ATOM 893 HA CYS A 57 11.401 -14.805 -2.059 1.00 0.00 H ATOM 894 HB2 CYS A 57 13.994 -14.626 -3.141 1.00 0.00 H ATOM 895 HB3 CYS A 57 13.550 -12.960 -2.700 1.00 0.00 H ATOM 896 HG CYS A 57 12.961 -13.331 -5.477 1.00 0.00 H ATOM 897 H CYS A 57 12.520 -12.451 -0.978 1.00 0.00 H ATOM 898 N ARG A 58 14.011 -15.393 -0.184 1.00 63.13 N ATOM 899 CA ARG A 58 14.779 -16.444 0.472 1.00 24.11 C ATOM 900 C ARG A 58 13.891 -17.268 1.400 1.00 2.20 C ATOM 901 O ARG A 58 13.930 -18.498 1.381 1.00 41.33 O ATOM 902 CB ARG A 58 15.940 -15.838 1.264 1.00 34.42 C ATOM 903 CG ARG A 58 17.030 -16.840 1.609 1.00 11.31 C ATOM 904 CD ARG A 58 17.815 -16.407 2.837 1.00 4.02 C ATOM 905 NE ARG A 58 18.762 -15.337 2.533 1.00 72.23 N ATOM 906 CZ ARG A 58 19.475 -14.702 3.456 1.00 63.30 C ATOM 907 NH1 ARG A 58 19.351 -15.028 4.735 1.00 34.31 N ATOM 908 NH2 ARG A 58 20.316 -13.739 3.100 1.00 21.33 N ATOM 909 HA ARG A 58 15.179 -17.103 -0.299 1.00 0.00 H ATOM 910 HB2 ARG A 58 16.382 -15.038 0.670 1.00 0.00 H ATOM 911 HB3 ARG A 58 15.546 -15.424 2.192 1.00 0.00 H ATOM 912 HG2 ARG A 58 16.572 -17.809 1.805 1.00 0.00 H ATOM 913 HG3 ARG A 58 17.713 -16.926 0.764 1.00 0.00 H ATOM 914 HD2 ARG A 58 18.365 -17.265 3.224 1.00 0.00 H ATOM 915 HD3 ARG A 58 17.116 -16.054 3.595 1.00 0.00 H ATOM 916 HE ARG A 58 18.885 -15.057 1.539 1.00 0.00 H ATOM 917 HH12 ARG A 58 19.911 -14.529 5.455 1.00 0.00 H ATOM 918 HH11 ARG A 58 18.694 -15.783 5.018 1.00 0.00 H ATOM 919 HH22 ARG A 58 20.874 -13.242 3.823 1.00 0.00 H ATOM 920 HH21 ARG A 58 20.417 -13.481 2.098 1.00 0.00 H ATOM 921 H ARG A 58 14.165 -14.403 0.095 1.00 0.00 H ATOM 922 N GLN A 59 13.093 -16.581 2.211 1.00 41.42 N ATOM 923 CA GLN A 59 12.197 -17.249 3.146 1.00 33.25 C ATOM 924 C GLN A 59 11.191 -18.124 2.406 1.00 72.21 C ATOM 925 O GLN A 59 10.947 -19.268 2.791 1.00 64.44 O ATOM 926 CB GLN A 59 11.460 -16.219 4.004 1.00 1.04 C ATOM 927 CG GLN A 59 11.902 -16.211 5.459 1.00 74.30 C ATOM 928 CD GLN A 59 11.151 -15.191 6.291 1.00 12.34 C ATOM 929 OE1 GLN A 59 10.620 -14.212 5.765 1.00 64.23 O ATOM 930 NE2 GLN A 59 11.102 -15.414 7.599 1.00 13.14 N ATOM 931 HA GLN A 59 12.799 -17.887 3.793 1.00 0.00 H ATOM 932 HB2 GLN A 59 11.638 -15.229 3.584 1.00 0.00 H ATOM 933 HB3 GLN A 59 10.393 -16.441 3.969 1.00 0.00 H ATOM 934 HG2 GLN A 59 11.731 -17.201 5.882 1.00 0.00 H ATOM 935 HG3 GLN A 59 12.966 -15.979 5.500 1.00 0.00 H ATOM 936 HE22 GLN A 59 11.565 -16.254 8.001 1.00 0.00 H ATOM 937 HE21 GLN A 59 10.601 -14.749 8.222 1.00 0.00 H ATOM 938 H GLN A 59 13.108 -15.542 2.177 1.00 0.00 H ATOM 939 N ILE A 60 10.609 -17.579 1.343 1.00 44.31 N ATOM 940 CA ILE A 60 9.631 -18.310 0.549 1.00 75.44 C ATOM 941 C ILE A 60 10.184 -19.658 0.099 1.00 20.55 C ATOM 942 O ILE A 60 9.462 -20.656 0.058 1.00 3.13 O ATOM 943 CB ILE A 60 9.198 -17.507 -0.692 1.00 1.31 C ATOM 944 CG1 ILE A 60 8.607 -16.159 -0.273 1.00 34.22 C ATOM 945 CG2 ILE A 60 8.193 -18.300 -1.513 1.00 73.11 C ATOM 946 CD1 ILE A 60 8.557 -15.146 -1.395 1.00 1.12 C ATOM 947 HA ILE A 60 8.763 -18.470 1.189 1.00 0.00 H ATOM 948 HB ILE A 60 10.076 -17.321 -1.311 1.00 0.00 H ATOM 949 HG12 ILE A 60 7.592 -16.324 0.088 1.00 0.00 H ATOM 950 HG13 ILE A 60 9.216 -15.751 0.534 1.00 0.00 H ATOM 951 HD11 ILE A 60 9.567 -14.960 -1.760 1.00 0.00 H ATOM 952 HD12 ILE A 60 7.941 -15.534 -2.206 1.00 0.00 H ATOM 953 HD13 ILE A 60 8.127 -14.216 -1.024 1.00 0.00 H ATOM 954 HG21 ILE A 60 8.648 -19.236 -1.836 1.00 0.00 H ATOM 955 HG22 ILE A 60 7.315 -18.513 -0.903 1.00 0.00 H ATOM 956 HG23 ILE A 60 7.898 -17.717 -2.386 1.00 0.00 H ATOM 957 H ILE A 60 10.858 -16.606 1.071 1.00 0.00 H ATOM 958 N LEU A 61 11.469 -19.682 -0.235 1.00 25.22 N ATOM 959 CA LEU A 61 12.122 -20.909 -0.679 1.00 51.14 C ATOM 960 C LEU A 61 12.350 -21.859 0.491 1.00 23.45 C ATOM 961 O LEU A 61 12.422 -23.075 0.313 1.00 14.51 O ATOM 962 CB LEU A 61 13.455 -20.585 -1.355 1.00 43.53 C ATOM 963 CG LEU A 61 13.377 -19.720 -2.614 1.00 11.31 C ATOM 964 CD1 LEU A 61 14.696 -19.000 -2.850 1.00 73.10 C ATOM 965 CD2 LEU A 61 13.006 -20.568 -3.822 1.00 4.03 C ATOM 966 HA LEU A 61 11.467 -21.400 -1.399 1.00 0.00 H ATOM 967 HB2 LEU A 61 14.079 -20.063 -0.630 1.00 0.00 H ATOM 968 HB3 LEU A 61 13.929 -21.528 -1.627 1.00 0.00 H ATOM 969 HG LEU A 61 12.599 -18.971 -2.469 1.00 0.00 H ATOM 970 HD21 LEU A 61 13.762 -21.340 -3.968 1.00 0.00 H ATOM 971 HD22 LEU A 61 12.036 -21.035 -3.652 1.00 0.00 H ATOM 972 HD23 LEU A 61 12.956 -19.934 -4.707 1.00 0.00 H ATOM 973 HD11 LEU A 61 14.918 -18.362 -1.995 1.00 0.00 H ATOM 974 HD12 LEU A 61 15.492 -19.734 -2.973 1.00 0.00 H ATOM 975 HD13 LEU A 61 14.620 -18.390 -3.750 1.00 0.00 H ATOM 976 H LEU A 61 12.024 -18.804 -0.179 1.00 0.00 H ATOM 977 N GLY A 62 12.462 -21.297 1.691 1.00 1.40 N ATOM 978 CA GLY A 62 12.679 -22.109 2.874 1.00 11.31 C ATOM 979 C GLY A 62 11.471 -22.954 3.226 1.00 21.32 C ATOM 980 O GLY A 62 11.612 -24.088 3.683 1.00 21.21 O ATOM 981 HA3 GLY A 62 12.903 -21.451 3.714 1.00 0.00 H ATOM 982 HA2 GLY A 62 13.528 -22.769 2.695 1.00 0.00 H ATOM 983 H GLY A 62 12.393 -20.263 1.783 1.00 0.00 H ATOM 984 N GLN A 63 10.281 -22.401 3.015 1.00 44.12 N ATOM 985 CA GLN A 63 9.044 -23.112 3.316 1.00 44.14 C ATOM 986 C GLN A 63 8.688 -24.083 2.195 1.00 50.44 C ATOM 987 O GLN A 63 8.053 -25.112 2.429 1.00 52.33 O ATOM 988 CB GLN A 63 7.900 -22.120 3.530 1.00 2.41 C ATOM 989 CG GLN A 63 7.560 -21.891 4.994 1.00 54.22 C ATOM 990 CD GLN A 63 6.992 -20.509 5.252 1.00 74.12 C ATOM 991 OE1 GLN A 63 5.795 -20.275 5.079 1.00 21.05 O ATOM 992 NE2 GLN A 63 7.849 -19.584 5.668 1.00 62.44 N ATOM 993 HA GLN A 63 9.196 -23.683 4.232 1.00 0.00 H ATOM 994 HB2 GLN A 63 8.184 -21.165 3.088 1.00 0.00 H ATOM 995 HB3 GLN A 63 7.013 -22.502 3.025 1.00 0.00 H ATOM 996 HG2 GLN A 63 6.824 -22.634 5.302 1.00 0.00 H ATOM 997 HG3 GLN A 63 8.467 -22.012 5.586 1.00 0.00 H ATOM 998 HE22 GLN A 63 8.852 -19.826 5.801 1.00 0.00 H ATOM 999 HE21 GLN A 63 7.518 -18.617 5.861 1.00 0.00 H ATOM 1000 H GLN A 63 10.231 -21.438 2.626 1.00 0.00 H ATOM 1001 N LEU A 64 9.100 -23.749 0.977 1.00 41.23 N ATOM 1002 CA LEU A 64 8.824 -24.591 -0.182 1.00 61.20 C ATOM 1003 C LEU A 64 9.859 -25.705 -0.305 1.00 3.42 C ATOM 1004 O LEU A 64 9.582 -26.762 -0.870 1.00 64.11 O ATOM 1005 CB LEU A 64 8.811 -23.748 -1.458 1.00 60.35 C ATOM 1006 CG LEU A 64 7.592 -22.846 -1.654 1.00 44.34 C ATOM 1007 CD1 LEU A 64 7.846 -21.841 -2.768 1.00 33.13 C ATOM 1008 CD2 LEU A 64 6.355 -23.678 -1.956 1.00 60.53 C ATOM 1009 HA LEU A 64 7.843 -25.046 -0.044 1.00 0.00 H ATOM 1010 HB2 LEU A 64 9.697 -23.114 -1.448 1.00 0.00 H ATOM 1011 HB3 LEU A 64 8.863 -24.428 -2.308 1.00 0.00 H ATOM 1012 HG LEU A 64 7.418 -22.297 -0.729 1.00 0.00 H ATOM 1013 HD21 LEU A 64 6.520 -24.254 -2.867 1.00 0.00 H ATOM 1014 HD22 LEU A 64 6.163 -24.357 -1.125 1.00 0.00 H ATOM 1015 HD23 LEU A 64 5.499 -23.017 -2.092 1.00 0.00 H ATOM 1016 HD11 LEU A 64 8.706 -21.223 -2.509 1.00 0.00 H ATOM 1017 HD12 LEU A 64 8.046 -22.374 -3.698 1.00 0.00 H ATOM 1018 HD13 LEU A 64 6.967 -21.208 -2.892 1.00 0.00 H ATOM 1019 H LEU A 64 9.633 -22.865 0.846 1.00 0.00 H ATOM 1020 N GLN A 65 11.051 -25.459 0.230 1.00 30.32 N ATOM 1021 CA GLN A 65 12.127 -26.442 0.181 1.00 33.45 C ATOM 1022 C GLN A 65 11.653 -27.794 0.707 1.00 44.33 C ATOM 1023 O GLN A 65 11.646 -28.797 -0.007 1.00 54.44 O ATOM 1024 CB GLN A 65 13.327 -25.957 0.996 1.00 31.12 C ATOM 1025 CG GLN A 65 14.464 -25.419 0.143 1.00 50.21 C ATOM 1026 CD GLN A 65 15.740 -26.222 0.297 1.00 61.53 C ATOM 1027 OE1 GLN A 65 16.544 -25.967 1.194 1.00 71.20 O ATOM 1028 NE2 GLN A 65 15.933 -27.201 -0.580 1.00 43.22 N ATOM 1029 HA GLN A 65 12.428 -26.562 -0.860 1.00 0.00 H ATOM 1030 HB2 GLN A 65 12.992 -25.164 1.664 1.00 0.00 H ATOM 1031 HB3 GLN A 65 13.704 -26.793 1.586 1.00 0.00 H ATOM 1032 HG2 GLN A 65 14.159 -25.446 -0.903 1.00 0.00 H ATOM 1033 HG3 GLN A 65 14.663 -24.388 0.436 1.00 0.00 H ATOM 1034 HE22 GLN A 65 15.227 -27.381 -1.322 1.00 0.00 H ATOM 1035 HE21 GLN A 65 16.790 -27.787 -0.525 1.00 0.00 H ATOM 1036 H GLN A 65 11.220 -24.544 0.694 1.00 0.00 H ATOM 1037 N PRO A 66 11.249 -27.824 1.985 1.00 3.44 N ATOM 1038 CA PRO A 66 10.767 -29.046 2.635 1.00 71.03 C ATOM 1039 C PRO A 66 9.413 -29.494 2.094 1.00 24.21 C ATOM 1040 O PRO A 66 9.004 -30.638 2.291 1.00 75.10 O ATOM 1041 CB PRO A 66 10.648 -28.643 4.107 1.00 51.45 C ATOM 1042 CG PRO A 66 10.452 -27.166 4.080 1.00 72.01 C ATOM 1043 CD PRO A 66 11.232 -26.666 2.895 1.00 33.04 C ATOM 1044 HA PRO A 66 11.435 -29.890 2.463 1.00 0.00 H ATOM 1045 HD3 PRO A 66 10.735 -25.813 2.432 1.00 0.00 H ATOM 1046 HD2 PRO A 66 12.244 -26.382 3.185 1.00 0.00 H ATOM 1047 HG3 PRO A 66 10.829 -26.717 4.999 1.00 0.00 H ATOM 1048 HG2 PRO A 66 9.395 -26.926 3.967 1.00 0.00 H ATOM 1049 HB2 PRO A 66 9.795 -29.136 4.573 1.00 0.00 H ATOM 1050 HB3 PRO A 66 11.557 -28.901 4.651 1.00 0.00 H ATOM 1051 N SER A 67 8.724 -28.586 1.412 1.00 54.24 N ATOM 1052 CA SER A 67 7.414 -28.887 0.845 1.00 21.12 C ATOM 1053 C SER A 67 7.554 -29.589 -0.502 1.00 74.22 C ATOM 1054 O SER A 67 6.672 -30.343 -0.917 1.00 51.21 O ATOM 1055 CB SER A 67 6.598 -27.603 0.682 1.00 31.51 C ATOM 1056 OG SER A 67 6.337 -27.002 1.938 1.00 34.25 O ATOM 1057 HA SER A 67 6.893 -29.555 1.531 1.00 0.00 H ATOM 1058 HB2 SER A 67 5.651 -27.842 0.197 1.00 0.00 H ATOM 1059 HB3 SER A 67 7.156 -26.902 0.061 1.00 0.00 H ATOM 1060 HG SER A 67 7.194 -26.779 2.380 1.00 0.00 H ATOM 1061 H SER A 67 9.128 -27.637 1.279 1.00 0.00 H ATOM 1062 N LEU A 68 8.667 -29.337 -1.181 1.00 50.52 N ATOM 1063 CA LEU A 68 8.924 -29.944 -2.483 1.00 11.44 C ATOM 1064 C LEU A 68 8.755 -31.458 -2.420 1.00 35.21 C ATOM 1065 O LEU A 68 8.373 -32.090 -3.404 1.00 61.35 O ATOM 1066 CB LEU A 68 10.335 -29.596 -2.960 1.00 22.23 C ATOM 1067 CG LEU A 68 10.509 -28.214 -3.590 1.00 43.00 C ATOM 1068 CD1 LEU A 68 11.970 -27.791 -3.554 1.00 74.00 C ATOM 1069 CD2 LEU A 68 9.986 -28.210 -5.019 1.00 11.41 C ATOM 1070 HA LEU A 68 8.199 -29.545 -3.192 1.00 0.00 H ATOM 1071 HB2 LEU A 68 11.002 -29.657 -2.100 1.00 0.00 H ATOM 1072 HB3 LEU A 68 10.630 -30.340 -3.700 1.00 0.00 H ATOM 1073 HG LEU A 68 9.930 -27.496 -3.010 1.00 0.00 H ATOM 1074 HD21 LEU A 68 10.539 -28.941 -5.609 1.00 0.00 H ATOM 1075 HD22 LEU A 68 8.927 -28.468 -5.018 1.00 0.00 H ATOM 1076 HD23 LEU A 68 10.119 -27.218 -5.450 1.00 0.00 H ATOM 1077 HD11 LEU A 68 12.311 -27.754 -2.519 1.00 0.00 H ATOM 1078 HD12 LEU A 68 12.569 -28.512 -4.110 1.00 0.00 H ATOM 1079 HD13 LEU A 68 12.073 -26.805 -4.007 1.00 0.00 H ATOM 1080 H LEU A 68 9.373 -28.691 -0.775 1.00 0.00 H ATOM 1081 N GLN A 69 9.039 -32.033 -1.255 1.00 53.45 N ATOM 1082 CA GLN A 69 8.916 -33.473 -1.065 1.00 10.14 C ATOM 1083 C GLN A 69 7.485 -33.936 -1.319 1.00 2.23 C ATOM 1084 O GLN A 69 7.257 -34.959 -1.965 1.00 43.13 O ATOM 1085 CB GLN A 69 9.346 -33.859 0.352 1.00 72.54 C ATOM 1086 CG GLN A 69 9.469 -35.360 0.562 1.00 44.03 C ATOM 1087 CD GLN A 69 10.887 -35.861 0.369 1.00 21.35 C ATOM 1088 OE1 GLN A 69 11.751 -35.139 -0.129 1.00 70.31 O ATOM 1089 NE2 GLN A 69 11.134 -37.105 0.765 1.00 4.51 N ATOM 1090 HA GLN A 69 9.570 -33.967 -1.784 1.00 0.00 H ATOM 1091 HB2 GLN A 69 10.314 -33.402 0.555 1.00 0.00 H ATOM 1092 HB3 GLN A 69 8.608 -33.472 1.054 1.00 0.00 H ATOM 1093 HG2 GLN A 69 9.149 -35.598 1.576 1.00 0.00 H ATOM 1094 HG3 GLN A 69 8.819 -35.867 -0.151 1.00 0.00 H ATOM 1095 HE22 GLN A 69 10.373 -37.679 1.181 1.00 0.00 H ATOM 1096 HE21 GLN A 69 12.088 -37.505 0.659 1.00 0.00 H ATOM 1097 H GLN A 69 9.356 -31.441 -0.461 1.00 0.00 H ATOM 1098 N THR A 70 6.523 -33.176 -0.805 1.00 75.13 N ATOM 1099 CA THR A 70 5.114 -33.509 -0.975 1.00 52.10 C ATOM 1100 C THR A 70 4.349 -32.355 -1.614 1.00 24.11 C ATOM 1101 O THR A 70 3.244 -32.020 -1.191 1.00 32.32 O ATOM 1102 CB THR A 70 4.454 -33.864 0.371 1.00 3.20 C ATOM 1103 OG1 THR A 70 5.400 -34.521 1.222 1.00 42.21 O ATOM 1104 CG2 THR A 70 3.244 -34.762 0.161 1.00 44.43 C ATOM 1105 HA THR A 70 5.072 -34.377 -1.632 1.00 0.00 H ATOM 1106 HB THR A 70 4.122 -32.939 0.843 1.00 0.00 H ATOM 1107 HG1 THR A 70 4.967 -34.745 2.084 1.00 0.00 H ATOM 1108 HG23 THR A 70 2.527 -34.258 -0.487 1.00 0.00 H ATOM 1109 HG21 THR A 70 3.562 -35.695 -0.304 1.00 0.00 H ATOM 1110 HG22 THR A 70 2.779 -34.974 1.124 1.00 0.00 H ATOM 1111 H THR A 70 6.782 -32.323 -0.269 1.00 0.00 H ATOM 1112 N GLY A 71 4.946 -31.750 -2.637 1.00 20.12 N ATOM 1113 CA GLY A 71 4.306 -30.640 -3.318 1.00 72.10 C ATOM 1114 C GLY A 71 3.769 -31.028 -4.682 1.00 24.44 C ATOM 1115 O GLY A 71 4.282 -31.948 -5.319 1.00 21.31 O ATOM 1116 HA3 GLY A 71 5.035 -29.839 -3.444 1.00 0.00 H ATOM 1117 HA2 GLY A 71 3.479 -30.283 -2.705 1.00 0.00 H ATOM 1118 H GLY A 71 5.882 -32.076 -2.952 1.00 0.00 H ATOM 1119 N SER A 72 2.733 -30.327 -5.130 1.00 2.11 N ATOM 1120 CA SER A 72 2.123 -30.607 -6.424 1.00 42.14 C ATOM 1121 C SER A 72 2.698 -29.695 -7.504 1.00 62.54 C ATOM 1122 O SER A 72 3.665 -28.971 -7.270 1.00 32.34 O ATOM 1123 CB SER A 72 0.606 -30.429 -6.346 1.00 33.21 C ATOM 1124 OG SER A 72 0.232 -29.096 -6.647 1.00 41.22 O ATOM 1125 HA SER A 72 2.347 -31.641 -6.687 1.00 0.00 H ATOM 1126 HB2 SER A 72 0.270 -30.674 -5.339 1.00 0.00 H ATOM 1127 HB3 SER A 72 0.131 -31.102 -7.060 1.00 0.00 H ATOM 1128 HG SER A 72 -0.753 -29.010 -6.589 1.00 0.00 H ATOM 1129 H SER A 72 2.348 -29.560 -4.543 1.00 0.00 H ATOM 1130 N GLU A 73 2.095 -29.738 -8.689 1.00 24.24 N ATOM 1131 CA GLU A 73 2.548 -28.917 -9.805 1.00 70.14 C ATOM 1132 C GLU A 73 2.635 -27.448 -9.400 1.00 64.45 C ATOM 1133 O GLU A 73 3.543 -26.732 -9.821 1.00 11.42 O ATOM 1134 CB GLU A 73 1.602 -29.073 -10.998 1.00 63.21 C ATOM 1135 CG GLU A 73 2.179 -28.554 -12.304 1.00 41.42 C ATOM 1136 CD GLU A 73 1.117 -28.328 -13.362 1.00 54.32 C ATOM 1137 OE1 GLU A 73 -0.071 -28.587 -13.076 1.00 62.44 O ATOM 1138 OE2 GLU A 73 1.473 -27.891 -14.477 1.00 3.45 O ATOM 1139 HA GLU A 73 3.543 -29.256 -10.092 1.00 0.00 H ATOM 1140 HB2 GLU A 73 1.372 -30.131 -11.119 1.00 0.00 H ATOM 1141 HB3 GLU A 73 0.684 -28.525 -10.784 1.00 0.00 H ATOM 1142 HG2 GLU A 73 2.686 -27.609 -12.111 1.00 0.00 H ATOM 1143 HG3 GLU A 73 2.899 -29.281 -12.681 1.00 0.00 H ATOM 1144 H GLU A 73 1.282 -30.372 -8.822 1.00 0.00 H ATOM 1145 N GLU A 74 1.685 -27.009 -8.582 1.00 14.40 N ATOM 1146 CA GLU A 74 1.654 -25.625 -8.122 1.00 34.44 C ATOM 1147 C GLU A 74 2.912 -25.288 -7.328 1.00 3.15 C ATOM 1148 O GLU A 74 3.558 -24.267 -7.570 1.00 20.33 O ATOM 1149 CB GLU A 74 0.413 -25.379 -7.261 1.00 11.31 C ATOM 1150 CG GLU A 74 -0.424 -24.198 -7.724 1.00 0.14 C ATOM 1151 CD GLU A 74 -1.896 -24.364 -7.400 1.00 10.53 C ATOM 1152 OE1 GLU A 74 -2.210 -24.977 -6.359 1.00 24.45 O ATOM 1153 OE2 GLU A 74 -2.735 -23.878 -8.188 1.00 64.50 O ATOM 1154 HA GLU A 74 1.614 -24.978 -8.998 1.00 0.00 H ATOM 1155 HB2 GLU A 74 -0.209 -26.274 -7.288 1.00 0.00 H ATOM 1156 HB3 GLU A 74 0.735 -25.193 -6.237 1.00 0.00 H ATOM 1157 HG2 GLU A 74 -0.058 -23.296 -7.233 1.00 0.00 H ATOM 1158 HG3 GLU A 74 -0.313 -24.093 -8.803 1.00 0.00 H ATOM 1159 H GLU A 74 0.946 -27.667 -8.262 1.00 0.00 H ATOM 1160 N LEU A 75 3.255 -26.152 -6.378 1.00 52.42 N ATOM 1161 CA LEU A 75 4.436 -25.946 -5.547 1.00 31.21 C ATOM 1162 C LEU A 75 5.701 -25.912 -6.398 1.00 24.33 C ATOM 1163 O LEU A 75 6.649 -25.189 -6.090 1.00 51.11 O ATOM 1164 CB LEU A 75 4.543 -27.053 -4.497 1.00 23.14 C ATOM 1165 CG LEU A 75 5.076 -26.630 -3.127 1.00 52.42 C ATOM 1166 CD1 LEU A 75 4.383 -27.409 -2.021 1.00 34.15 C ATOM 1167 CD2 LEU A 75 6.583 -26.826 -3.057 1.00 22.30 C ATOM 1168 HA LEU A 75 4.334 -24.985 -5.044 1.00 0.00 H ATOM 1169 HB2 LEU A 75 3.548 -27.473 -4.353 1.00 0.00 H ATOM 1170 HB3 LEU A 75 5.207 -27.823 -4.890 1.00 0.00 H ATOM 1171 HG LEU A 75 4.861 -25.571 -2.986 1.00 0.00 H ATOM 1172 HD21 LEU A 75 6.819 -27.878 -3.220 1.00 0.00 H ATOM 1173 HD22 LEU A 75 7.063 -26.221 -3.826 1.00 0.00 H ATOM 1174 HD23 LEU A 75 6.943 -26.519 -2.075 1.00 0.00 H ATOM 1175 HD11 LEU A 75 3.311 -27.216 -2.059 1.00 0.00 H ATOM 1176 HD12 LEU A 75 4.567 -28.475 -2.159 1.00 0.00 H ATOM 1177 HD13 LEU A 75 4.776 -27.093 -1.055 1.00 0.00 H ATOM 1178 H LEU A 75 2.667 -26.996 -6.223 1.00 0.00 H ATOM 1179 N ARG A 76 5.709 -26.698 -7.470 1.00 12.14 N ATOM 1180 CA ARG A 76 6.857 -26.757 -8.366 1.00 3.13 C ATOM 1181 C ARG A 76 7.102 -25.403 -9.026 1.00 23.14 C ATOM 1182 O ARG A 76 8.162 -24.800 -8.854 1.00 33.21 O ATOM 1183 CB ARG A 76 6.641 -27.827 -9.437 1.00 54.14 C ATOM 1184 CG ARG A 76 7.498 -29.067 -9.242 1.00 50.45 C ATOM 1185 CD ARG A 76 6.653 -30.277 -8.876 1.00 52.43 C ATOM 1186 NE ARG A 76 7.471 -31.403 -8.437 1.00 24.32 N ATOM 1187 CZ ARG A 76 6.971 -32.506 -7.890 1.00 43.03 C ATOM 1188 NH1 ARG A 76 5.663 -32.629 -7.718 1.00 34.55 N ATOM 1189 NH2 ARG A 76 7.781 -33.488 -7.516 1.00 20.32 N ATOM 1190 HA ARG A 76 7.735 -27.017 -7.774 1.00 0.00 H ATOM 1191 HB2 ARG A 76 5.593 -28.126 -9.419 1.00 0.00 H ATOM 1192 HB3 ARG A 76 6.877 -27.394 -10.409 1.00 0.00 H ATOM 1193 HG2 ARG A 76 8.034 -29.276 -10.167 1.00 0.00 H ATOM 1194 HG3 ARG A 76 8.215 -28.880 -8.442 1.00 0.00 H ATOM 1195 HD2 ARG A 76 6.076 -30.581 -9.749 1.00 0.00 H ATOM 1196 HD3 ARG A 76 5.973 -30.001 -8.070 1.00 0.00 H ATOM 1197 HE ARG A 76 8.502 -31.339 -8.559 1.00 0.00 H ATOM 1198 HH12 ARG A 76 5.274 -33.493 -7.290 1.00 0.00 H ATOM 1199 HH11 ARG A 76 5.025 -31.861 -8.011 1.00 0.00 H ATOM 1200 HH22 ARG A 76 7.389 -34.351 -7.088 1.00 0.00 H ATOM 1201 HH21 ARG A 76 8.808 -33.395 -7.651 1.00 0.00 H ATOM 1202 H ARG A 76 4.875 -27.285 -7.674 1.00 0.00 H ATOM 1203 N SER A 77 6.116 -24.932 -9.781 1.00 55.41 N ATOM 1204 CA SER A 77 6.225 -23.651 -10.470 1.00 64.35 C ATOM 1205 C SER A 77 6.628 -22.545 -9.500 1.00 52.23 C ATOM 1206 O SER A 77 7.303 -21.586 -9.879 1.00 33.34 O ATOM 1207 CB SER A 77 4.899 -23.296 -11.145 1.00 61.13 C ATOM 1208 OG SER A 77 4.753 -23.984 -12.376 1.00 14.14 O ATOM 1209 HA SER A 77 6.999 -23.741 -11.232 1.00 0.00 H ATOM 1210 HB2 SER A 77 4.870 -22.222 -11.331 1.00 0.00 H ATOM 1211 HB3 SER A 77 4.078 -23.571 -10.483 1.00 0.00 H ATOM 1212 HG SER A 77 3.889 -23.737 -12.791 1.00 0.00 H ATOM 1213 H SER A 77 5.245 -25.490 -9.883 1.00 0.00 H ATOM 1214 N LEU A 78 6.209 -22.684 -8.247 1.00 72.14 N ATOM 1215 CA LEU A 78 6.525 -21.697 -7.221 1.00 13.02 C ATOM 1216 C LEU A 78 8.011 -21.722 -6.880 1.00 62.30 C ATOM 1217 O LEU A 78 8.740 -20.772 -7.165 1.00 42.14 O ATOM 1218 CB LEU A 78 5.697 -21.959 -5.962 1.00 14.05 C ATOM 1219 CG LEU A 78 4.627 -20.917 -5.633 1.00 31.01 C ATOM 1220 CD1 LEU A 78 3.656 -20.764 -6.794 1.00 23.04 C ATOM 1221 CD2 LEU A 78 3.884 -21.298 -4.361 1.00 31.43 C ATOM 1222 HA LEU A 78 6.278 -20.710 -7.613 1.00 0.00 H ATOM 1223 HB2 LEU A 78 5.199 -22.921 -6.084 1.00 0.00 H ATOM 1224 HB3 LEU A 78 6.383 -22.011 -5.117 1.00 0.00 H ATOM 1225 HG LEU A 78 5.119 -19.958 -5.469 1.00 0.00 H ATOM 1226 HD21 LEU A 78 3.404 -22.267 -4.498 1.00 0.00 H ATOM 1227 HD22 LEU A 78 4.590 -21.355 -3.532 1.00 0.00 H ATOM 1228 HD23 LEU A 78 3.127 -20.544 -4.144 1.00 0.00 H ATOM 1229 HD11 LEU A 78 4.201 -20.444 -7.682 1.00 0.00 H ATOM 1230 HD12 LEU A 78 3.171 -21.721 -6.989 1.00 0.00 H ATOM 1231 HD13 LEU A 78 2.903 -20.018 -6.540 1.00 0.00 H ATOM 1232 H LEU A 78 5.642 -23.517 -7.991 1.00 0.00 H ATOM 1233 N TYR A 79 8.454 -22.816 -6.270 1.00 64.14 N ATOM 1234 CA TYR A 79 9.854 -22.965 -5.891 1.00 22.43 C ATOM 1235 C TYR A 79 10.773 -22.699 -7.079 1.00 74.05 C ATOM 1236 O TYR A 79 11.902 -22.239 -6.915 1.00 34.11 O ATOM 1237 CB TYR A 79 10.108 -24.370 -5.340 1.00 41.24 C ATOM 1238 CG TYR A 79 11.495 -24.554 -4.767 1.00 11.24 C ATOM 1239 CD1 TYR A 79 11.801 -24.115 -3.484 1.00 50.12 C ATOM 1240 CD2 TYR A 79 12.499 -25.165 -5.507 1.00 21.33 C ATOM 1241 CE1 TYR A 79 13.067 -24.280 -2.956 1.00 33.12 C ATOM 1242 CE2 TYR A 79 13.767 -25.336 -4.986 1.00 21.01 C ATOM 1243 CZ TYR A 79 14.046 -24.892 -3.710 1.00 41.33 C ATOM 1244 OH TYR A 79 15.308 -25.059 -3.189 1.00 4.45 O ATOM 1245 HA TYR A 79 10.073 -22.232 -5.115 1.00 0.00 H ATOM 1246 HB3 TYR A 79 9.971 -25.088 -6.149 1.00 0.00 H ATOM 1247 HB2 TYR A 79 9.381 -24.568 -4.553 1.00 0.00 H ATOM 1248 HD2 TYR A 79 12.283 -25.516 -6.516 1.00 0.00 H ATOM 1249 HE2 TYR A 79 14.543 -25.819 -5.580 1.00 0.00 H ATOM 1250 HE1 TYR A 79 13.291 -23.928 -1.949 1.00 0.00 H ATOM 1251 HD1 TYR A 79 11.029 -23.632 -2.884 1.00 0.00 H ATOM 1252 HH TYR A 79 15.337 -24.688 -2.272 1.00 0.00 H ATOM 1253 H TYR A 79 7.786 -23.584 -6.058 1.00 0.00 H ATOM 1254 N ASN A 80 10.278 -22.992 -8.278 1.00 2.30 N ATOM 1255 CA ASN A 80 11.053 -22.784 -9.496 1.00 21.21 C ATOM 1256 C ASN A 80 11.180 -21.297 -9.813 1.00 64.30 C ATOM 1257 O ASN A 80 12.278 -20.795 -10.059 1.00 14.44 O ATOM 1258 CB ASN A 80 10.400 -23.514 -10.671 1.00 52.24 C ATOM 1259 CG ASN A 80 10.745 -24.990 -10.700 1.00 24.12 C ATOM 1260 OD1 ASN A 80 11.382 -25.508 -9.782 1.00 43.42 O ATOM 1261 ND2 ASN A 80 10.326 -25.676 -11.757 1.00 13.41 N ATOM 1262 HA ASN A 80 12.052 -23.189 -9.335 1.00 0.00 H ATOM 1263 HB2 ASN A 80 9.318 -23.409 -10.591 1.00 0.00 H ATOM 1264 HB3 ASN A 80 10.740 -23.057 -11.600 1.00 0.00 H ATOM 1265 HD22 ASN A 80 9.791 -25.197 -12.509 1.00 0.00 H ATOM 1266 HD21 ASN A 80 10.533 -26.692 -11.833 1.00 0.00 H ATOM 1267 H ASN A 80 9.315 -23.379 -8.349 1.00 0.00 H ATOM 1268 N THR A 81 10.050 -20.597 -9.806 1.00 22.24 N ATOM 1269 CA THR A 81 10.034 -19.168 -10.093 1.00 23.53 C ATOM 1270 C THR A 81 10.725 -18.378 -8.987 1.00 54.22 C ATOM 1271 O THR A 81 11.668 -17.629 -9.243 1.00 53.33 O ATOM 1272 CB THR A 81 8.595 -18.645 -10.261 1.00 23.23 C ATOM 1273 OG1 THR A 81 7.913 -19.401 -11.267 1.00 65.55 O ATOM 1274 CG2 THR A 81 8.596 -17.172 -10.639 1.00 40.14 C ATOM 1275 HA THR A 81 10.575 -19.027 -11.029 1.00 0.00 H ATOM 1276 HB THR A 81 8.077 -18.759 -9.309 1.00 0.00 H ATOM 1277 HG1 THR A 81 7.884 -20.354 -11.000 1.00 0.00 H ATOM 1278 HG23 THR A 81 9.116 -16.601 -9.870 1.00 0.00 H ATOM 1279 HG21 THR A 81 9.104 -17.044 -11.595 1.00 0.00 H ATOM 1280 HG22 THR A 81 7.568 -16.819 -10.722 1.00 0.00 H ATOM 1281 H THR A 81 9.155 -21.081 -9.590 1.00 0.00 H ATOM 1282 N ILE A 82 10.250 -18.550 -7.758 1.00 54.22 N ATOM 1283 CA ILE A 82 10.823 -17.853 -6.614 1.00 2.03 C ATOM 1284 C ILE A 82 12.334 -18.050 -6.551 1.00 0.21 C ATOM 1285 O ILE A 82 13.063 -17.188 -6.061 1.00 53.52 O ATOM 1286 CB ILE A 82 10.199 -18.334 -5.291 1.00 33.43 C ATOM 1287 CG1 ILE A 82 8.684 -18.119 -5.308 1.00 70.24 C ATOM 1288 CG2 ILE A 82 10.829 -17.607 -4.112 1.00 73.22 C ATOM 1289 CD1 ILE A 82 7.899 -19.310 -4.806 1.00 75.43 C ATOM 1290 HA ILE A 82 10.602 -16.794 -6.747 1.00 0.00 H ATOM 1291 HB ILE A 82 10.395 -19.401 -5.182 1.00 0.00 H ATOM 1292 HG12 ILE A 82 8.450 -17.261 -4.678 1.00 0.00 H ATOM 1293 HG13 ILE A 82 8.377 -17.910 -6.333 1.00 0.00 H ATOM 1294 HD11 ILE A 82 8.113 -20.175 -5.433 1.00 0.00 H ATOM 1295 HD12 ILE A 82 8.187 -19.526 -3.777 1.00 0.00 H ATOM 1296 HD13 ILE A 82 6.833 -19.085 -4.847 1.00 0.00 H ATOM 1297 HG21 ILE A 82 11.900 -17.808 -4.093 1.00 0.00 H ATOM 1298 HG22 ILE A 82 10.660 -16.535 -4.216 1.00 0.00 H ATOM 1299 HG23 ILE A 82 10.376 -17.959 -3.185 1.00 0.00 H ATOM 1300 H ILE A 82 9.450 -19.198 -7.609 1.00 0.00 H ATOM 1301 N ALA A 83 12.798 -19.190 -7.052 1.00 30.12 N ATOM 1302 CA ALA A 83 14.223 -19.499 -7.056 1.00 55.24 C ATOM 1303 C ALA A 83 14.985 -18.561 -7.986 1.00 54.32 C ATOM 1304 O ALA A 83 16.034 -18.028 -7.624 1.00 32.42 O ATOM 1305 CB ALA A 83 14.447 -20.947 -7.465 1.00 23.22 C ATOM 1306 HA ALA A 83 14.604 -19.355 -6.045 1.00 0.00 H ATOM 1307 HB1 ALA A 83 13.941 -21.605 -6.759 1.00 0.00 H ATOM 1308 HB2 ALA A 83 14.044 -21.107 -8.465 1.00 0.00 H ATOM 1309 HB3 ALA A 83 15.515 -21.163 -7.463 1.00 0.00 H ATOM 1310 H ALA A 83 12.128 -19.879 -7.451 1.00 0.00 H ATOM 1311 N VAL A 84 14.450 -18.363 -9.187 1.00 44.43 N ATOM 1312 CA VAL A 84 15.080 -17.488 -10.169 1.00 62.23 C ATOM 1313 C VAL A 84 15.060 -16.036 -9.705 1.00 24.20 C ATOM 1314 O VAL A 84 16.087 -15.356 -9.713 1.00 64.13 O ATOM 1315 CB VAL A 84 14.382 -17.587 -11.539 1.00 21.34 C ATOM 1316 CG1 VAL A 84 15.034 -16.647 -12.540 1.00 44.52 C ATOM 1317 CG2 VAL A 84 14.408 -19.021 -12.047 1.00 34.04 C ATOM 1318 HA VAL A 84 16.113 -17.820 -10.271 1.00 0.00 H ATOM 1319 HB VAL A 84 13.341 -17.286 -11.420 1.00 0.00 H ATOM 1320 HG11 VAL A 84 14.958 -15.622 -12.177 1.00 0.00 H ATOM 1321 HG12 VAL A 84 16.084 -16.915 -12.657 1.00 0.00 H ATOM 1322 HG13 VAL A 84 14.526 -16.732 -13.501 1.00 0.00 H ATOM 1323 HG21 VAL A 84 15.442 -19.350 -12.151 1.00 0.00 H ATOM 1324 HG22 VAL A 84 13.890 -19.666 -11.337 1.00 0.00 H ATOM 1325 HG23 VAL A 84 13.910 -19.071 -13.016 1.00 0.00 H ATOM 1326 H VAL A 84 13.561 -18.844 -9.432 1.00 0.00 H ATOM 1327 N LEU A 85 13.886 -15.567 -9.300 1.00 13.43 N ATOM 1328 CA LEU A 85 13.731 -14.194 -8.830 1.00 42.04 C ATOM 1329 C LEU A 85 14.659 -13.914 -7.652 1.00 54.43 C ATOM 1330 O LEU A 85 15.217 -12.823 -7.535 1.00 1.43 O ATOM 1331 CB LEU A 85 12.280 -13.933 -8.425 1.00 35.33 C ATOM 1332 CG LEU A 85 11.821 -12.475 -8.472 1.00 31.43 C ATOM 1333 CD1 LEU A 85 11.655 -12.014 -9.911 1.00 63.14 C ATOM 1334 CD2 LEU A 85 10.521 -12.300 -7.701 1.00 33.13 C ATOM 1335 HA LEU A 85 13.999 -13.524 -9.647 1.00 0.00 H ATOM 1336 HB2 LEU A 85 11.639 -14.506 -9.094 1.00 0.00 H ATOM 1337 HB3 LEU A 85 12.149 -14.291 -7.404 1.00 0.00 H ATOM 1338 HG LEU A 85 12.586 -11.858 -8.000 1.00 0.00 H ATOM 1339 HD21 LEU A 85 9.749 -12.929 -8.145 1.00 0.00 H ATOM 1340 HD22 LEU A 85 10.675 -12.590 -6.662 1.00 0.00 H ATOM 1341 HD23 LEU A 85 10.211 -11.256 -7.746 1.00 0.00 H ATOM 1342 HD11 LEU A 85 12.609 -12.102 -10.432 1.00 0.00 H ATOM 1343 HD12 LEU A 85 10.910 -12.636 -10.407 1.00 0.00 H ATOM 1344 HD13 LEU A 85 11.328 -10.974 -9.923 1.00 0.00 H ATOM 1345 H LEU A 85 13.056 -16.194 -9.318 1.00 0.00 H ATOM 1346 N TYR A 86 14.820 -14.906 -6.784 1.00 14.31 N ATOM 1347 CA TYR A 86 15.679 -14.766 -5.615 1.00 4.04 C ATOM 1348 C TYR A 86 17.122 -14.492 -6.029 1.00 11.22 C ATOM 1349 O TYR A 86 17.713 -13.486 -5.633 1.00 31.44 O ATOM 1350 CB TYR A 86 15.615 -16.029 -4.754 1.00 63.25 C ATOM 1351 CG TYR A 86 16.630 -16.051 -3.634 1.00 12.45 C ATOM 1352 CD1 TYR A 86 16.639 -15.060 -2.659 1.00 63.05 C ATOM 1353 CD2 TYR A 86 17.578 -17.063 -3.548 1.00 43.50 C ATOM 1354 CE1 TYR A 86 17.565 -15.075 -1.634 1.00 71.41 C ATOM 1355 CE2 TYR A 86 18.507 -17.087 -2.525 1.00 53.33 C ATOM 1356 CZ TYR A 86 18.496 -16.091 -1.571 1.00 43.32 C ATOM 1357 OH TYR A 86 19.419 -16.110 -0.551 1.00 20.45 O ATOM 1358 HA TYR A 86 15.320 -13.918 -5.032 1.00 0.00 H ATOM 1359 HB3 TYR A 86 15.791 -16.893 -5.395 1.00 0.00 H ATOM 1360 HB2 TYR A 86 14.619 -16.099 -4.318 1.00 0.00 H ATOM 1361 HD2 TYR A 86 17.589 -17.852 -4.300 1.00 0.00 H ATOM 1362 HE2 TYR A 86 19.244 -17.888 -2.472 1.00 0.00 H ATOM 1363 HE1 TYR A 86 17.560 -14.289 -0.879 1.00 0.00 H ATOM 1364 HD1 TYR A 86 15.903 -14.257 -2.704 1.00 0.00 H ATOM 1365 HH TYR A 86 19.272 -15.330 0.040 1.00 0.00 H ATOM 1366 H TYR A 86 14.321 -15.805 -6.942 1.00 0.00 H ATOM 1367 N CYS A 87 17.682 -15.392 -6.828 1.00 70.45 N ATOM 1368 CA CYS A 87 19.056 -15.249 -7.298 1.00 33.24 C ATOM 1369 C CYS A 87 19.276 -13.876 -7.923 1.00 4.43 C ATOM 1370 O CYS A 87 20.366 -13.309 -7.833 1.00 54.14 O ATOM 1371 CB CYS A 87 19.387 -16.344 -8.313 1.00 33.12 C ATOM 1372 SG CYS A 87 19.950 -17.893 -7.570 1.00 64.32 S ATOM 1373 HA CYS A 87 19.720 -15.348 -6.439 1.00 0.00 H ATOM 1374 HB2 CYS A 87 20.173 -15.974 -8.972 1.00 0.00 H ATOM 1375 HB3 CYS A 87 18.491 -16.551 -8.899 1.00 0.00 H ATOM 1376 HG CYS A 87 20.220 -18.808 -8.567 1.00 0.00 H ATOM 1377 H CYS A 87 17.128 -16.220 -7.126 1.00 0.00 H ATOM 1378 N VAL A 88 18.235 -13.346 -8.557 1.00 45.14 N ATOM 1379 CA VAL A 88 18.315 -12.039 -9.198 1.00 43.25 C ATOM 1380 C VAL A 88 18.556 -10.937 -8.172 1.00 65.35 C ATOM 1381 O VAL A 88 19.287 -9.981 -8.433 1.00 0.34 O ATOM 1382 CB VAL A 88 17.030 -11.720 -9.985 1.00 60.11 C ATOM 1383 CG1 VAL A 88 17.149 -10.371 -10.678 1.00 72.45 C ATOM 1384 CG2 VAL A 88 16.735 -12.822 -10.991 1.00 53.04 C ATOM 1385 HA VAL A 88 19.156 -12.077 -9.890 1.00 0.00 H ATOM 1386 HB VAL A 88 16.198 -11.668 -9.283 1.00 0.00 H ATOM 1387 HG11 VAL A 88 17.309 -9.593 -9.931 1.00 0.00 H ATOM 1388 HG12 VAL A 88 17.992 -10.392 -11.369 1.00 0.00 H ATOM 1389 HG13 VAL A 88 16.231 -10.164 -11.228 1.00 0.00 H ATOM 1390 HG21 VAL A 88 17.567 -12.907 -11.690 1.00 0.00 H ATOM 1391 HG22 VAL A 88 16.603 -13.767 -10.464 1.00 0.00 H ATOM 1392 HG23 VAL A 88 15.824 -12.579 -11.537 1.00 0.00 H ATOM 1393 H VAL A 88 17.341 -13.877 -8.597 1.00 0.00 H ATOM 1394 N HIS A 89 17.938 -11.078 -7.004 1.00 70.53 N ATOM 1395 CA HIS A 89 18.086 -10.095 -5.936 1.00 72.53 C ATOM 1396 C HIS A 89 19.368 -10.342 -5.146 1.00 33.42 C ATOM 1397 O HIS A 89 19.774 -9.428 -4.429 1.00 71.03 O ATOM 1398 CB HIS A 89 16.878 -10.143 -4.999 1.00 65.11 C ATOM 1399 CG HIS A 89 15.578 -9.854 -5.684 1.00 13.34 C ATOM 1400 ND1 HIS A 89 15.474 -9.033 -6.786 1.00 53.24 N ATOM 1401 CD2 HIS A 89 14.322 -10.282 -5.416 1.00 70.21 C ATOM 1402 CE1 HIS A 89 14.210 -8.968 -7.167 1.00 23.42 C ATOM 1403 NE2 HIS A 89 13.491 -9.719 -6.352 1.00 12.43 N ATOM 1404 HA HIS A 89 18.144 -9.106 -6.390 1.00 0.00 H ATOM 1405 HB2 HIS A 89 16.822 -11.138 -4.558 1.00 0.00 H ATOM 1406 HB3 HIS A 89 17.024 -9.405 -4.210 1.00 0.00 H ATOM 1407 HD2 HIS A 89 14.026 -10.950 -4.607 1.00 0.00 H ATOM 1408 HE1 HIS A 89 13.826 -8.393 -8.010 1.00 0.00 H ATOM 1409 H HIS A 89 17.334 -11.910 -6.847 1.00 0.00 H ATOM 1410 N GLN A 90 19.992 -11.511 -5.253 1.00 14.00 N ATOM 1411 CA GLN A 90 21.218 -11.792 -4.516 1.00 42.23 C ATOM 1412 C GLN A 90 22.445 -11.555 -5.391 1.00 71.31 C ATOM 1413 O GLN A 90 23.501 -12.149 -5.170 1.00 75.15 O ATOM 1414 CB GLN A 90 21.212 -13.233 -4.005 1.00 23.42 C ATOM 1415 CG GLN A 90 20.330 -13.442 -2.785 1.00 21.35 C ATOM 1416 CD GLN A 90 21.122 -13.829 -1.551 1.00 62.22 C ATOM 1417 OE1 GLN A 90 21.171 -13.084 -0.572 1.00 23.42 O ATOM 1418 NE2 GLN A 90 21.748 -15.000 -1.592 1.00 51.32 N ATOM 1419 HA GLN A 90 21.264 -11.113 -3.665 1.00 0.00 H ATOM 1420 HB2 GLN A 90 20.854 -13.881 -4.805 1.00 0.00 H ATOM 1421 HB3 GLN A 90 22.233 -13.511 -3.744 1.00 0.00 H ATOM 1422 HG2 GLN A 90 19.793 -12.516 -2.579 1.00 0.00 H ATOM 1423 HG3 GLN A 90 19.614 -14.234 -3.003 1.00 0.00 H ATOM 1424 HE22 GLN A 90 21.679 -15.597 -2.441 1.00 0.00 H ATOM 1425 HE21 GLN A 90 22.307 -15.320 -0.775 1.00 0.00 H ATOM 1426 H GLN A 90 19.596 -12.242 -5.877 1.00 0.00 H ATOM 1427 N ARG A 91 22.298 -10.685 -6.385 1.00 1.34 N ATOM 1428 CA ARG A 91 23.394 -10.371 -7.294 1.00 32.13 C ATOM 1429 C ARG A 91 23.924 -11.636 -7.963 1.00 10.21 C ATOM 1430 O ARG A 91 25.088 -11.698 -8.360 1.00 72.31 O ATOM 1431 CB ARG A 91 24.524 -9.668 -6.540 1.00 43.45 C ATOM 1432 CG ARG A 91 25.101 -8.474 -7.284 1.00 12.33 C ATOM 1433 CD ARG A 91 24.567 -7.162 -6.730 1.00 2.03 C ATOM 1434 NE ARG A 91 25.388 -6.657 -5.632 1.00 73.30 N ATOM 1435 CZ ARG A 91 26.607 -6.156 -5.796 1.00 70.21 C ATOM 1436 NH1 ARG A 91 27.144 -6.093 -7.007 1.00 11.23 N ATOM 1437 NH2 ARG A 91 27.292 -5.717 -4.748 1.00 15.42 N ATOM 1438 HA ARG A 91 23.013 -9.704 -8.067 1.00 0.00 H ATOM 1439 HB2 ARG A 91 24.137 -9.323 -5.581 1.00 0.00 H ATOM 1440 HB3 ARG A 91 25.325 -10.388 -6.369 1.00 0.00 H ATOM 1441 HG2 ARG A 91 26.186 -8.485 -7.185 1.00 0.00 H ATOM 1442 HG3 ARG A 91 24.833 -8.549 -8.338 1.00 0.00 H ATOM 1443 HD2 ARG A 91 23.552 -7.320 -6.367 1.00 0.00 H ATOM 1444 HD3 ARG A 91 24.554 -6.421 -7.530 1.00 0.00 H ATOM 1445 HE ARG A 91 24.996 -6.692 -4.669 1.00 0.00 H ATOM 1446 HH12 ARG A 91 28.099 -5.700 -7.133 1.00 0.00 H ATOM 1447 HH11 ARG A 91 26.610 -6.436 -7.831 1.00 0.00 H ATOM 1448 HH22 ARG A 91 28.246 -5.325 -4.878 1.00 0.00 H ATOM 1449 HH21 ARG A 91 26.874 -5.765 -3.797 1.00 0.00 H ATOM 1450 H ARG A 91 21.379 -10.217 -6.518 1.00 0.00 H ATOM 1451 N ILE A 92 23.063 -12.641 -8.083 1.00 51.54 N ATOM 1452 CA ILE A 92 23.445 -13.903 -8.705 1.00 15.34 C ATOM 1453 C ILE A 92 23.017 -13.947 -10.168 1.00 14.14 C ATOM 1454 O ILE A 92 21.991 -13.379 -10.542 1.00 53.24 O ATOM 1455 CB ILE A 92 22.827 -15.104 -7.964 1.00 43.13 C ATOM 1456 CG1 ILE A 92 23.069 -14.982 -6.458 1.00 41.24 C ATOM 1457 CG2 ILE A 92 23.405 -16.407 -8.495 1.00 63.22 C ATOM 1458 CD1 ILE A 92 22.477 -16.120 -5.657 1.00 64.22 C ATOM 1459 HA ILE A 92 24.531 -13.969 -8.645 1.00 0.00 H ATOM 1460 HB ILE A 92 21.751 -15.107 -8.140 1.00 0.00 H ATOM 1461 HG12 ILE A 92 24.144 -14.959 -6.282 1.00 0.00 H ATOM 1462 HG13 ILE A 92 22.625 -14.049 -6.112 1.00 0.00 H ATOM 1463 HD11 ILE A 92 21.399 -16.150 -5.813 1.00 0.00 H ATOM 1464 HD12 ILE A 92 22.919 -17.061 -5.984 1.00 0.00 H ATOM 1465 HD13 ILE A 92 22.688 -15.966 -4.599 1.00 0.00 H ATOM 1466 HG21 ILE A 92 23.185 -16.494 -9.559 1.00 0.00 H ATOM 1467 HG22 ILE A 92 24.484 -16.412 -8.344 1.00 0.00 H ATOM 1468 HG23 ILE A 92 22.958 -17.246 -7.961 1.00 0.00 H ATOM 1469 H ILE A 92 22.094 -12.525 -7.725 1.00 0.00 H ATOM 1470 N ASP A 93 23.808 -14.627 -10.989 1.00 44.25 N ATOM 1471 CA ASP A 93 23.510 -14.748 -12.412 1.00 24.42 C ATOM 1472 C ASP A 93 23.325 -16.211 -12.805 1.00 52.41 C ATOM 1473 O ASP A 93 24.187 -17.049 -12.544 1.00 24.15 O ATOM 1474 CB ASP A 93 24.630 -14.121 -13.245 1.00 34.54 C ATOM 1475 CG ASP A 93 25.999 -14.651 -12.866 1.00 11.20 C ATOM 1476 OD1 ASP A 93 26.343 -15.771 -13.298 1.00 35.31 O ATOM 1477 OD2 ASP A 93 26.727 -13.944 -12.139 1.00 23.24 O ATOM 1478 HA ASP A 93 22.579 -14.216 -12.610 1.00 0.00 H ATOM 1479 HB2 ASP A 93 24.449 -14.340 -14.297 1.00 0.00 H ATOM 1480 HB3 ASP A 93 24.618 -13.042 -13.093 1.00 0.00 H ATOM 1481 H ASP A 93 24.661 -15.085 -10.609 1.00 0.00 H ATOM 1482 N VAL A 94 22.193 -16.510 -13.434 1.00 53.12 N ATOM 1483 CA VAL A 94 21.893 -17.871 -13.864 1.00 4.33 C ATOM 1484 C VAL A 94 21.337 -17.889 -15.283 1.00 33.22 C ATOM 1485 O VAL A 94 21.058 -16.841 -15.866 1.00 65.45 O ATOM 1486 CB VAL A 94 20.883 -18.548 -12.919 1.00 21.02 C ATOM 1487 CG1 VAL A 94 21.425 -18.588 -11.498 1.00 32.40 C ATOM 1488 CG2 VAL A 94 19.544 -17.829 -12.967 1.00 53.53 C ATOM 1489 HA VAL A 94 22.831 -18.425 -13.838 1.00 0.00 H ATOM 1490 HB VAL A 94 20.731 -19.574 -13.253 1.00 0.00 H ATOM 1491 HG11 VAL A 94 22.358 -19.152 -11.482 1.00 0.00 H ATOM 1492 HG12 VAL A 94 21.608 -17.571 -11.151 1.00 0.00 H ATOM 1493 HG13 VAL A 94 20.697 -19.070 -10.846 1.00 0.00 H ATOM 1494 HG21 VAL A 94 19.678 -16.792 -12.658 1.00 0.00 H ATOM 1495 HG22 VAL A 94 19.153 -17.859 -13.984 1.00 0.00 H ATOM 1496 HG23 VAL A 94 18.844 -18.322 -12.293 1.00 0.00 H ATOM 1497 H VAL A 94 21.504 -15.755 -13.624 1.00 0.00 H ATOM 1498 N LYS A 95 21.176 -19.088 -15.834 1.00 14.44 N ATOM 1499 CA LYS A 95 20.650 -19.245 -17.185 1.00 1.14 C ATOM 1500 C LYS A 95 19.276 -19.906 -17.160 1.00 53.12 C ATOM 1501 O LYS A 95 18.429 -19.632 -18.011 1.00 44.33 O ATOM 1502 CB LYS A 95 21.613 -20.077 -18.035 1.00 11.22 C ATOM 1503 CG LYS A 95 22.710 -19.256 -18.691 1.00 35.01 C ATOM 1504 CD LYS A 95 22.998 -19.738 -20.103 1.00 22.33 C ATOM 1505 CE LYS A 95 22.178 -18.975 -21.131 1.00 51.21 C ATOM 1506 NZ LYS A 95 21.737 -19.852 -22.251 1.00 13.13 N ATOM 1507 HA LYS A 95 20.549 -18.254 -17.627 1.00 0.00 H ATOM 1508 HB2 LYS A 95 22.079 -20.826 -17.395 1.00 0.00 H ATOM 1509 HB3 LYS A 95 21.040 -20.575 -18.817 1.00 0.00 H ATOM 1510 HG2 LYS A 95 22.397 -18.213 -18.730 1.00 0.00 H ATOM 1511 HG3 LYS A 95 23.619 -19.339 -18.096 1.00 0.00 H ATOM 1512 HD2 LYS A 95 24.057 -19.595 -20.317 1.00 0.00 H ATOM 1513 HD3 LYS A 95 22.755 -20.798 -20.172 1.00 0.00 H ATOM 1514 HE2 LYS A 95 22.785 -18.165 -21.535 1.00 0.00 H ATOM 1515 HE3 LYS A 95 21.298 -18.559 -20.641 1.00 0.00 H ATOM 1516 HZ1 LYS A 95 22.572 -20.249 -22.728 1.00 0.00 H ATOM 1517 HZ2 LYS A 95 21.151 -20.625 -21.875 1.00 0.00 H ATOM 1518 HZ3 LYS A 95 21.181 -19.293 -22.929 1.00 0.00 H ATOM 1519 H LYS A 95 21.432 -19.935 -15.288 1.00 0.00 H ATOM 1520 N ASP A 96 19.060 -20.776 -16.180 1.00 0.24 N ATOM 1521 CA ASP A 96 17.787 -21.474 -16.043 1.00 50.10 C ATOM 1522 C ASP A 96 17.374 -21.570 -14.578 1.00 3.35 C ATOM 1523 O ASP A 96 18.097 -21.121 -13.687 1.00 33.03 O ATOM 1524 CB ASP A 96 17.881 -22.874 -16.652 1.00 12.21 C ATOM 1525 CG ASP A 96 19.003 -23.694 -16.047 1.00 32.43 C ATOM 1526 OD1 ASP A 96 20.156 -23.549 -16.503 1.00 0.04 O ATOM 1527 OD2 ASP A 96 18.727 -24.483 -15.118 1.00 5.42 O ATOM 1528 HA ASP A 96 17.028 -20.903 -16.578 1.00 0.00 H ATOM 1529 HB2 ASP A 96 16.938 -23.393 -16.484 1.00 0.00 H ATOM 1530 HB3 ASP A 96 18.055 -22.779 -17.724 1.00 0.00 H ATOM 1531 H ASP A 96 19.818 -20.964 -15.493 1.00 0.00 H ATOM 1532 N THR A 97 16.207 -22.157 -14.334 1.00 14.21 N ATOM 1533 CA THR A 97 15.696 -22.309 -12.977 1.00 62.53 C ATOM 1534 C THR A 97 16.552 -23.282 -12.174 1.00 5.31 C ATOM 1535 O THR A 97 16.914 -23.007 -11.029 1.00 60.54 O ATOM 1536 CB THR A 97 14.238 -22.807 -12.978 1.00 44.12 C ATOM 1537 OG1 THR A 97 13.401 -21.870 -13.665 1.00 44.20 O ATOM 1538 CG2 THR A 97 13.732 -23.000 -11.557 1.00 32.41 C ATOM 1539 HA THR A 97 15.735 -21.324 -12.512 1.00 0.00 H ATOM 1540 HB THR A 97 14.205 -23.768 -13.492 1.00 0.00 H ATOM 1541 HG1 THR A 97 13.713 -21.773 -14.599 1.00 0.00 H ATOM 1542 HG23 THR A 97 14.372 -23.714 -11.039 1.00 0.00 H ATOM 1543 HG21 THR A 97 13.752 -22.045 -11.033 1.00 0.00 H ATOM 1544 HG22 THR A 97 12.711 -23.379 -11.585 1.00 0.00 H ATOM 1545 H THR A 97 15.644 -22.517 -15.131 1.00 0.00 H ATOM 1546 N LYS A 98 16.875 -24.419 -12.780 1.00 71.13 N ATOM 1547 CA LYS A 98 17.691 -25.433 -12.123 1.00 1.33 C ATOM 1548 C LYS A 98 19.021 -24.845 -11.661 1.00 60.13 C ATOM 1549 O LYS A 98 19.477 -25.116 -10.551 1.00 63.43 O ATOM 1550 CB LYS A 98 17.942 -26.608 -13.070 1.00 31.33 C ATOM 1551 CG LYS A 98 18.222 -27.918 -12.353 1.00 13.22 C ATOM 1552 CD LYS A 98 19.713 -28.195 -12.260 1.00 72.32 C ATOM 1553 CE LYS A 98 19.991 -29.524 -11.574 1.00 11.11 C ATOM 1554 NZ LYS A 98 20.421 -30.570 -12.543 1.00 1.50 N ATOM 1555 HA LYS A 98 17.148 -25.790 -11.248 1.00 0.00 H ATOM 1556 HB2 LYS A 98 17.060 -26.740 -13.697 1.00 0.00 H ATOM 1557 HB3 LYS A 98 18.800 -26.368 -13.698 1.00 0.00 H ATOM 1558 HG2 LYS A 98 17.808 -27.866 -11.346 1.00 0.00 H ATOM 1559 HG3 LYS A 98 17.744 -28.731 -12.900 1.00 0.00 H ATOM 1560 HD2 LYS A 98 20.132 -28.221 -13.266 1.00 0.00 H ATOM 1561 HD3 LYS A 98 20.187 -27.396 -11.690 1.00 0.00 H ATOM 1562 HE2 LYS A 98 19.083 -29.859 -11.073 1.00 0.00 H ATOM 1563 HE3 LYS A 98 20.780 -29.382 -10.836 1.00 0.00 H ATOM 1564 HZ1 LYS A 98 19.671 -30.717 -13.248 1.00 0.00 H ATOM 1565 HZ2 LYS A 98 21.291 -30.261 -13.021 1.00 0.00 H ATOM 1566 HZ3 LYS A 98 20.600 -31.459 -12.034 1.00 0.00 H ATOM 1567 H LYS A 98 16.537 -24.590 -13.748 1.00 0.00 H ATOM 1568 N GLU A 99 19.636 -24.039 -12.520 1.00 44.45 N ATOM 1569 CA GLU A 99 20.914 -23.413 -12.199 1.00 53.11 C ATOM 1570 C GLU A 99 20.837 -22.673 -10.866 1.00 61.25 C ATOM 1571 O GLU A 99 21.706 -22.827 -10.008 1.00 73.14 O ATOM 1572 CB GLU A 99 21.326 -22.444 -13.309 1.00 61.35 C ATOM 1573 CG GLU A 99 22.211 -23.076 -14.371 1.00 32.41 C ATOM 1574 CD GLU A 99 23.586 -23.437 -13.845 1.00 24.12 C ATOM 1575 OE1 GLU A 99 24.431 -22.526 -13.716 1.00 73.22 O ATOM 1576 OE2 GLU A 99 23.818 -24.631 -13.561 1.00 61.23 O ATOM 1577 HA GLU A 99 21.664 -24.199 -12.116 1.00 0.00 H ATOM 1578 HB2 GLU A 99 20.424 -22.068 -13.791 1.00 0.00 H ATOM 1579 HB3 GLU A 99 21.868 -21.613 -12.858 1.00 0.00 H ATOM 1580 HG2 GLU A 99 21.727 -23.982 -14.735 1.00 0.00 H ATOM 1581 HG3 GLU A 99 22.326 -22.371 -15.195 1.00 0.00 H ATOM 1582 H GLU A 99 19.196 -23.850 -13.443 1.00 0.00 H ATOM 1583 N ALA A 100 19.792 -21.870 -10.702 1.00 15.42 N ATOM 1584 CA ALA A 100 19.600 -21.107 -9.474 1.00 60.04 C ATOM 1585 C ALA A 100 19.543 -22.027 -8.260 1.00 35.22 C ATOM 1586 O ALA A 100 20.133 -21.736 -7.219 1.00 10.23 O ATOM 1587 CB ALA A 100 18.333 -20.270 -9.565 1.00 74.14 C ATOM 1588 HA ALA A 100 20.454 -20.441 -9.352 1.00 0.00 H ATOM 1589 HB1 ALA A 100 18.415 -19.580 -10.404 1.00 0.00 H ATOM 1590 HB2 ALA A 100 17.476 -20.926 -9.715 1.00 0.00 H ATOM 1591 HB3 ALA A 100 18.204 -19.707 -8.641 1.00 0.00 H ATOM 1592 H ALA A 100 19.094 -21.783 -11.468 1.00 0.00 H ATOM 1593 N LEU A 101 18.828 -23.138 -8.399 1.00 31.34 N ATOM 1594 CA LEU A 101 18.693 -24.102 -7.312 1.00 14.24 C ATOM 1595 C LEU A 101 20.058 -24.616 -6.866 1.00 40.42 C ATOM 1596 O LEU A 101 20.312 -24.778 -5.673 1.00 21.14 O ATOM 1597 CB LEU A 101 17.812 -25.274 -7.749 1.00 10.40 C ATOM 1598 CG LEU A 101 16.423 -24.910 -8.275 1.00 41.31 C ATOM 1599 CD1 LEU A 101 15.617 -26.166 -8.566 1.00 54.41 C ATOM 1600 CD2 LEU A 101 15.691 -24.022 -7.279 1.00 21.42 C ATOM 1601 HA LEU A 101 18.223 -23.597 -6.469 1.00 0.00 H ATOM 1602 HB2 LEU A 101 18.338 -25.810 -8.539 1.00 0.00 H ATOM 1603 HB3 LEU A 101 17.681 -25.932 -6.890 1.00 0.00 H ATOM 1604 HG LEU A 101 16.542 -24.356 -9.206 1.00 0.00 H ATOM 1605 HD21 LEU A 101 15.584 -24.552 -6.332 1.00 0.00 H ATOM 1606 HD22 LEU A 101 16.262 -23.107 -7.122 1.00 0.00 H ATOM 1607 HD23 LEU A 101 14.705 -23.774 -7.672 1.00 0.00 H ATOM 1608 HD11 LEU A 101 16.135 -26.763 -9.317 1.00 0.00 H ATOM 1609 HD12 LEU A 101 15.508 -26.747 -7.650 1.00 0.00 H ATOM 1610 HD13 LEU A 101 14.632 -25.886 -8.939 1.00 0.00 H ATOM 1611 H LEU A 101 18.353 -23.325 -9.305 1.00 0.00 H ATOM 1612 N ASP A 102 20.934 -24.867 -7.833 1.00 74.30 N ATOM 1613 CA ASP A 102 22.275 -25.359 -7.541 1.00 31.43 C ATOM 1614 C ASP A 102 23.050 -24.354 -6.694 1.00 71.51 C ATOM 1615 O ASP A 102 23.812 -24.733 -5.804 1.00 41.23 O ATOM 1616 CB ASP A 102 23.032 -25.642 -8.839 1.00 72.04 C ATOM 1617 CG ASP A 102 22.377 -26.731 -9.666 1.00 55.32 C ATOM 1618 OD1 ASP A 102 21.735 -27.623 -9.072 1.00 5.10 O ATOM 1619 OD2 ASP A 102 22.504 -26.690 -10.908 1.00 30.14 O ATOM 1620 HA ASP A 102 22.180 -26.286 -6.976 1.00 0.00 H ATOM 1621 HB2 ASP A 102 23.068 -24.727 -9.430 1.00 0.00 H ATOM 1622 HB3 ASP A 102 24.047 -25.953 -8.592 1.00 0.00 H ATOM 1623 H ASP A 102 20.656 -24.709 -8.823 1.00 0.00 H ATOM 1624 N LYS A 103 22.851 -23.072 -6.978 1.00 13.35 N ATOM 1625 CA LYS A 103 23.530 -22.011 -6.243 1.00 51.00 C ATOM 1626 C LYS A 103 22.959 -21.873 -4.835 1.00 42.42 C ATOM 1627 O LYS A 103 23.704 -21.739 -3.864 1.00 43.30 O ATOM 1628 CB LYS A 103 23.401 -20.682 -6.990 1.00 54.32 C ATOM 1629 CG LYS A 103 24.728 -20.127 -7.478 1.00 54.24 C ATOM 1630 CD LYS A 103 25.166 -20.788 -8.774 1.00 73.43 C ATOM 1631 CE LYS A 103 26.434 -21.606 -8.582 1.00 10.41 C ATOM 1632 NZ LYS A 103 27.588 -20.753 -8.183 1.00 70.10 N ATOM 1633 HA LYS A 103 24.585 -22.275 -6.164 1.00 0.00 H ATOM 1634 HB2 LYS A 103 22.752 -20.833 -7.853 1.00 0.00 H ATOM 1635 HB3 LYS A 103 22.948 -19.952 -6.319 1.00 0.00 H ATOM 1636 HG2 LYS A 103 24.624 -19.055 -7.645 1.00 0.00 H ATOM 1637 HG3 LYS A 103 25.487 -20.303 -6.716 1.00 0.00 H ATOM 1638 HD2 LYS A 103 24.370 -21.445 -9.123 1.00 0.00 H ATOM 1639 HD3 LYS A 103 25.352 -20.016 -9.521 1.00 0.00 H ATOM 1640 HE2 LYS A 103 26.674 -22.110 -9.518 1.00 0.00 H ATOM 1641 HE3 LYS A 103 26.260 -22.350 -7.805 1.00 0.00 H ATOM 1642 HZ1 LYS A 103 27.765 -20.044 -8.923 1.00 0.00 H ATOM 1643 HZ2 LYS A 103 27.369 -20.273 -7.286 1.00 0.00 H ATOM 1644 HZ3 LYS A 103 28.432 -21.348 -8.062 1.00 0.00 H ATOM 1645 H LYS A 103 22.195 -22.818 -7.744 1.00 0.00 H ATOM 1646 N ILE A 104 21.635 -21.907 -4.733 1.00 31.25 N ATOM 1647 CA ILE A 104 20.966 -21.788 -3.443 1.00 71.20 C ATOM 1648 C ILE A 104 21.273 -22.987 -2.552 1.00 13.12 C ATOM 1649 O ILE A 104 21.317 -22.867 -1.328 1.00 72.20 O ATOM 1650 CB ILE A 104 19.440 -21.664 -3.610 1.00 31.01 C ATOM 1651 CG1 ILE A 104 19.097 -20.452 -4.478 1.00 52.21 C ATOM 1652 CG2 ILE A 104 18.765 -21.557 -2.250 1.00 44.34 C ATOM 1653 CD1 ILE A 104 17.685 -20.478 -5.021 1.00 43.43 C ATOM 1654 HA ILE A 104 21.347 -20.882 -2.972 1.00 0.00 H ATOM 1655 HB ILE A 104 19.070 -22.560 -4.108 1.00 0.00 H ATOM 1656 HG12 ILE A 104 19.219 -19.551 -3.877 1.00 0.00 H ATOM 1657 HG13 ILE A 104 19.790 -20.423 -5.319 1.00 0.00 H ATOM 1658 HD11 ILE A 104 17.550 -21.368 -5.635 1.00 0.00 H ATOM 1659 HD12 ILE A 104 16.978 -20.496 -4.191 1.00 0.00 H ATOM 1660 HD13 ILE A 104 17.514 -19.588 -5.627 1.00 0.00 H ATOM 1661 HG21 ILE A 104 18.988 -22.449 -1.664 1.00 0.00 H ATOM 1662 HG22 ILE A 104 19.139 -20.676 -1.729 1.00 0.00 H ATOM 1663 HG23 ILE A 104 17.687 -21.470 -2.387 1.00 0.00 H ATOM 1664 H ILE A 104 21.062 -22.021 -5.593 1.00 0.00 H ATOM 1665 N GLU A 105 21.486 -24.142 -3.175 1.00 53.31 N ATOM 1666 CA GLU A 105 21.790 -25.362 -2.437 1.00 73.35 C ATOM 1667 C GLU A 105 23.259 -25.398 -2.027 1.00 31.22 C ATOM 1668 O GLU A 105 23.606 -25.929 -0.972 1.00 71.14 O ATOM 1669 CB GLU A 105 21.455 -26.593 -3.284 1.00 1.45 C ATOM 1670 CG GLU A 105 21.153 -27.833 -2.460 1.00 70.53 C ATOM 1671 CD GLU A 105 21.294 -29.113 -3.261 1.00 73.42 C ATOM 1672 OE1 GLU A 105 20.425 -29.373 -4.121 1.00 24.25 O ATOM 1673 OE2 GLU A 105 22.271 -29.855 -3.029 1.00 1.11 O ATOM 1674 HA GLU A 105 21.179 -25.373 -1.535 1.00 0.00 H ATOM 1675 HB2 GLU A 105 20.582 -26.364 -3.896 1.00 0.00 H ATOM 1676 HB3 GLU A 105 22.305 -26.808 -3.932 1.00 0.00 H ATOM 1677 HG2 GLU A 105 21.844 -27.870 -1.618 1.00 0.00 H ATOM 1678 HG3 GLU A 105 20.131 -27.765 -2.087 1.00 0.00 H ATOM 1679 H GLU A 105 21.435 -24.176 -4.213 1.00 0.00 H ATOM 1680 N GLU A 106 24.117 -24.830 -2.868 1.00 53.34 N ATOM 1681 CA GLU A 106 25.548 -24.798 -2.593 1.00 64.15 C ATOM 1682 C GLU A 106 25.863 -23.832 -1.455 1.00 54.41 C ATOM 1683 O GLU A 106 26.737 -24.093 -0.630 1.00 44.51 O ATOM 1684 CB GLU A 106 26.323 -24.393 -3.850 1.00 14.25 C ATOM 1685 CG GLU A 106 27.821 -24.622 -3.742 1.00 33.54 C ATOM 1686 CD GLU A 106 28.342 -25.578 -4.797 1.00 71.40 C ATOM 1687 OE1 GLU A 106 27.595 -26.504 -5.179 1.00 41.20 O ATOM 1688 OE2 GLU A 106 29.496 -25.402 -5.241 1.00 14.34 O ATOM 1689 HA GLU A 106 25.856 -25.799 -2.292 1.00 0.00 H ATOM 1690 HB2 GLU A 106 25.945 -24.975 -4.691 1.00 0.00 H ATOM 1691 HB3 GLU A 106 26.149 -23.333 -4.036 1.00 0.00 H ATOM 1692 HG2 GLU A 106 28.330 -23.665 -3.856 1.00 0.00 H ATOM 1693 HG3 GLU A 106 28.041 -25.034 -2.757 1.00 0.00 H ATOM 1694 H GLU A 106 23.759 -24.398 -3.744 1.00 0.00 H ATOM 1695 N GLU A 107 25.142 -22.715 -1.419 1.00 3.21 N ATOM 1696 CA GLU A 107 25.345 -21.709 -0.383 1.00 44.10 C ATOM 1697 C GLU A 107 24.779 -22.181 0.953 1.00 74.43 C ATOM 1698 O GLU A 107 25.237 -21.763 2.015 1.00 0.23 O ATOM 1699 CB GLU A 107 24.690 -20.387 -0.789 1.00 32.22 C ATOM 1700 CG GLU A 107 25.662 -19.385 -1.388 1.00 54.33 C ATOM 1701 CD GLU A 107 24.974 -18.122 -1.870 1.00 11.24 C ATOM 1702 OE1 GLU A 107 23.828 -17.870 -1.443 1.00 32.21 O ATOM 1703 OE2 GLU A 107 25.583 -17.385 -2.673 1.00 40.04 O ATOM 1704 HA GLU A 107 26.418 -21.554 -0.268 1.00 0.00 H ATOM 1705 HB2 GLU A 107 23.915 -20.598 -1.526 1.00 0.00 H ATOM 1706 HB3 GLU A 107 24.237 -19.941 0.096 1.00 0.00 H ATOM 1707 HG2 GLU A 107 26.397 -19.115 -0.630 1.00 0.00 H ATOM 1708 HG3 GLU A 107 26.168 -19.851 -2.233 1.00 0.00 H ATOM 1709 H GLU A 107 24.416 -22.555 -2.147 1.00 0.00 H ATOM 1710 N GLN A 108 23.779 -23.055 0.889 1.00 51.12 N ATOM 1711 CA GLN A 108 23.149 -23.583 2.093 1.00 75.22 C ATOM 1712 C GLN A 108 23.924 -24.781 2.633 1.00 52.54 C ATOM 1713 O GLN A 108 24.054 -24.953 3.844 1.00 43.24 O ATOM 1714 CB GLN A 108 21.702 -23.986 1.802 1.00 70.33 C ATOM 1715 CG GLN A 108 20.960 -24.513 3.020 1.00 63.13 C ATOM 1716 CD GLN A 108 19.570 -25.015 2.684 1.00 32.13 C ATOM 1717 OE1 GLN A 108 19.175 -25.052 1.519 1.00 51.25 O ATOM 1718 NE2 GLN A 108 18.818 -25.406 3.707 1.00 4.31 N ATOM 1719 HA GLN A 108 23.155 -22.798 2.850 1.00 0.00 H ATOM 1720 HB2 GLN A 108 21.170 -23.113 1.425 1.00 0.00 H ATOM 1721 HB3 GLN A 108 21.708 -24.764 1.038 1.00 0.00 H ATOM 1722 HG2 GLN A 108 21.533 -25.334 3.450 1.00 0.00 H ATOM 1723 HG3 GLN A 108 20.874 -23.709 3.751 1.00 0.00 H ATOM 1724 HE22 GLN A 108 19.192 -25.358 4.676 1.00 0.00 H ATOM 1725 HE21 GLN A 108 17.855 -25.761 3.539 1.00 0.00 H ATOM 1726 H GLN A 108 23.438 -23.369 -0.042 1.00 0.00 H ATOM 1727 N ASN A 109 24.436 -25.606 1.725 1.00 11.50 N ATOM 1728 CA ASN A 109 25.198 -26.788 2.110 1.00 13.15 C ATOM 1729 C ASN A 109 26.368 -26.411 3.014 1.00 14.51 C ATOM 1730 O ASN A 109 26.803 -27.204 3.849 1.00 43.03 O ATOM 1731 CB ASN A 109 25.713 -27.516 0.867 1.00 2.32 C ATOM 1732 CG ASN A 109 24.757 -28.592 0.389 1.00 4.33 C ATOM 1733 OD1 ASN A 109 23.704 -28.812 0.987 1.00 10.02 O ATOM 1734 ND2 ASN A 109 25.122 -29.268 -0.694 1.00 30.13 N ATOM 1735 HA ASN A 109 24.534 -27.453 2.663 1.00 0.00 H ATOM 1736 HB2 ASN A 109 25.850 -26.789 0.067 1.00 0.00 H ATOM 1737 HB3 ASN A 109 26.671 -27.979 1.104 1.00 0.00 H ATOM 1738 HD22 ASN A 109 26.022 -29.047 -1.166 1.00 0.00 H ATOM 1739 HD21 ASN A 109 24.508 -30.019 -1.070 1.00 0.00 H ATOM 1740 H ASN A 109 24.289 -25.403 0.716 1.00 0.00 H ATOM 1741 N LYS A 110 26.872 -25.193 2.842 1.00 30.34 N ATOM 1742 CA LYS A 110 27.990 -24.708 3.643 1.00 61.03 C ATOM 1743 C LYS A 110 27.501 -24.131 4.967 1.00 1.22 C ATOM 1744 O LYS A 110 28.222 -24.143 5.964 1.00 4.05 O ATOM 1745 CB LYS A 110 28.774 -23.645 2.869 1.00 20.24 C ATOM 1746 CG LYS A 110 29.730 -24.223 1.841 1.00 62.35 C ATOM 1747 CD LYS A 110 30.910 -23.298 1.593 1.00 14.34 C ATOM 1748 CE LYS A 110 30.768 -22.554 0.274 1.00 33.02 C ATOM 1749 NZ LYS A 110 31.465 -23.258 -0.837 1.00 71.23 N ATOM 1750 HA LYS A 110 28.646 -25.552 3.856 1.00 0.00 H ATOM 1751 HB2 LYS A 110 28.063 -22.999 2.354 1.00 0.00 H ATOM 1752 HB3 LYS A 110 29.350 -23.054 3.581 1.00 0.00 H ATOM 1753 HG2 LYS A 110 30.102 -25.182 2.203 1.00 0.00 H ATOM 1754 HG3 LYS A 110 29.194 -24.373 0.904 1.00 0.00 H ATOM 1755 HD2 LYS A 110 30.968 -22.573 2.405 1.00 0.00 H ATOM 1756 HD3 LYS A 110 31.825 -23.890 1.570 1.00 0.00 H ATOM 1757 HE2 LYS A 110 31.195 -21.557 0.383 1.00 0.00 H ATOM 1758 HE3 LYS A 110 29.709 -22.469 0.029 1.00 0.00 H ATOM 1759 HZ1 LYS A 110 32.478 -23.337 -0.614 1.00 0.00 H ATOM 1760 HZ2 LYS A 110 31.059 -24.208 -0.953 1.00 0.00 H ATOM 1761 HZ3 LYS A 110 31.344 -22.718 -1.718 1.00 0.00 H ATOM 1762 H LYS A 110 26.459 -24.571 2.118 1.00 0.00 H ATOM 1763 N SER A 111 26.271 -23.627 4.970 1.00 70.01 N ATOM 1764 CA SER A 111 25.687 -23.043 6.172 1.00 73.24 C ATOM 1765 C SER A 111 24.784 -24.048 6.880 1.00 32.41 C ATOM 1766 O SER A 111 23.844 -23.671 7.580 1.00 31.23 O ATOM 1767 CB SER A 111 24.890 -21.786 5.818 1.00 42.22 C ATOM 1768 OG SER A 111 25.338 -20.671 6.569 1.00 52.53 O ATOM 1769 HA SER A 111 26.499 -22.772 6.846 1.00 0.00 H ATOM 1770 HB2 SER A 111 23.836 -21.960 6.033 1.00 0.00 H ATOM 1771 HB3 SER A 111 25.013 -21.573 4.756 1.00 0.00 H ATOM 1772 HG SER A 111 24.807 -19.873 6.321 1.00 0.00 H ATOM 1773 H SER A 111 25.711 -23.650 4.094 1.00 0.00 H ATOM 1774 N LYS A 112 25.076 -25.331 6.693 1.00 52.01 N ATOM 1775 CA LYS A 112 24.293 -26.393 7.314 1.00 50.03 C ATOM 1776 C LYS A 112 24.959 -26.881 8.596 1.00 31.13 C ATOM 1777 O LYS A 112 24.287 -27.163 9.589 1.00 50.52 O ATOM 1778 CB LYS A 112 24.118 -27.561 6.341 1.00 61.22 C ATOM 1779 CG LYS A 112 22.772 -27.570 5.637 1.00 63.22 C ATOM 1780 CD LYS A 112 21.666 -28.065 6.554 1.00 5.10 C ATOM 1781 CE LYS A 112 20.321 -27.461 6.181 1.00 21.11 C ATOM 1782 NZ LYS A 112 19.241 -27.898 7.109 1.00 40.53 N ATOM 1783 HA LYS A 112 23.313 -25.988 7.566 1.00 0.00 H ATOM 1784 HB2 LYS A 112 24.902 -27.501 5.586 1.00 0.00 H ATOM 1785 HB3 LYS A 112 24.222 -28.492 6.898 1.00 0.00 H ATOM 1786 HG2 LYS A 112 22.536 -26.557 5.312 1.00 0.00 H ATOM 1787 HG3 LYS A 112 22.831 -28.225 4.768 1.00 0.00 H ATOM 1788 HD2 LYS A 112 21.601 -29.150 6.477 1.00 0.00 H ATOM 1789 HD3 LYS A 112 21.906 -27.789 7.581 1.00 0.00 H ATOM 1790 HE2 LYS A 112 20.063 -27.771 5.168 1.00 0.00 H ATOM 1791 HE3 LYS A 112 20.400 -26.374 6.218 1.00 0.00 H ATOM 1792 HZ1 LYS A 112 19.155 -28.934 7.075 1.00 0.00 H ATOM 1793 HZ2 LYS A 112 19.476 -27.600 8.077 1.00 0.00 H ATOM 1794 HZ3 LYS A 112 18.341 -27.464 6.820 1.00 0.00 H ATOM 1795 H LYS A 112 25.883 -25.584 6.088 1.00 0.00 H ATOM 1796 N LYS A 113 26.284 -26.978 8.570 1.00 72.13 N ATOM 1797 CA LYS A 113 27.042 -27.429 9.731 1.00 72.44 C ATOM 1798 C LYS A 113 27.210 -26.301 10.743 1.00 52.21 C ATOM 1799 O LYS A 113 27.351 -26.544 11.942 1.00 50.13 O ATOM 1800 CB LYS A 113 28.415 -27.949 9.298 1.00 33.53 C ATOM 1801 CG LYS A 113 28.570 -29.453 9.448 1.00 3.10 C ATOM 1802 CD LYS A 113 29.467 -30.031 8.366 1.00 32.21 C ATOM 1803 CE LYS A 113 29.588 -31.542 8.492 1.00 61.25 C ATOM 1804 NZ LYS A 113 31.010 -31.986 8.500 1.00 13.33 N ATOM 1805 HA LYS A 113 26.486 -28.238 10.205 1.00 0.00 H ATOM 1806 HB2 LYS A 113 28.568 -27.689 8.250 1.00 0.00 H ATOM 1807 HB3 LYS A 113 29.176 -27.461 9.907 1.00 0.00 H ATOM 1808 HG2 LYS A 113 29.007 -29.669 10.423 1.00 0.00 H ATOM 1809 HG3 LYS A 113 27.587 -29.919 9.380 1.00 0.00 H ATOM 1810 HD2 LYS A 113 29.046 -29.789 7.390 1.00 0.00 H ATOM 1811 HD3 LYS A 113 30.459 -29.587 8.453 1.00 0.00 H ATOM 1812 HE2 LYS A 113 29.078 -32.008 7.649 1.00 0.00 H ATOM 1813 HE3 LYS A 113 29.115 -31.858 9.422 1.00 0.00 H ATOM 1814 HZ1 LYS A 113 31.468 -31.695 7.613 1.00 0.00 H ATOM 1815 HZ2 LYS A 113 31.503 -31.551 9.305 1.00 0.00 H ATOM 1816 HZ3 LYS A 113 31.048 -33.022 8.587 1.00 0.00 H ATOM 1817 H LYS A 113 26.793 -26.726 7.699 1.00 0.00 H ATOM 1818 N LYS A 114 27.192 -25.066 10.254 1.00 42.35 N ATOM 1819 CA LYS A 114 27.340 -23.899 11.115 1.00 14.41 C ATOM 1820 C LYS A 114 25.980 -23.288 11.441 1.00 4.03 C ATOM 1821 O LYS A 114 25.864 -22.079 11.638 1.00 11.12 O ATOM 1822 CB LYS A 114 28.232 -22.853 10.444 1.00 45.25 C ATOM 1823 CG LYS A 114 28.992 -21.980 11.427 1.00 1.31 C ATOM 1824 CD LYS A 114 29.976 -21.066 10.717 1.00 43.43 C ATOM 1825 CE LYS A 114 29.508 -19.619 10.738 1.00 4.52 C ATOM 1826 NZ LYS A 114 29.530 -19.049 12.114 1.00 0.00 N ATOM 1827 HA LYS A 114 27.807 -24.222 12.045 1.00 0.00 H ATOM 1828 HB2 LYS A 114 28.954 -23.370 9.812 1.00 0.00 H ATOM 1829 HB3 LYS A 114 27.605 -22.211 9.826 1.00 0.00 H ATOM 1830 HG2 LYS A 114 28.280 -21.370 11.983 1.00 0.00 H ATOM 1831 HG3 LYS A 114 29.539 -22.620 12.119 1.00 0.00 H ATOM 1832 HD2 LYS A 114 30.944 -21.133 11.214 1.00 0.00 H ATOM 1833 HD3 LYS A 114 30.078 -21.391 9.681 1.00 0.00 H ATOM 1834 HE2 LYS A 114 28.489 -19.572 10.353 1.00 0.00 H ATOM 1835 HE3 LYS A 114 30.164 -19.027 10.100 1.00 0.00 H ATOM 1836 HZ1 LYS A 114 28.901 -19.605 12.728 1.00 0.00 H ATOM 1837 HZ2 LYS A 114 30.500 -19.084 12.487 1.00 0.00 H ATOM 1838 HZ3 LYS A 114 29.204 -18.062 12.084 1.00 0.00 H ATOM 1839 H LYS A 114 27.069 -24.928 9.231 1.00 0.00 H ATOM 1840 N ALA A 115 24.956 -24.132 11.498 1.00 33.41 N ATOM 1841 CA ALA A 115 23.606 -23.676 11.804 1.00 13.21 C ATOM 1842 C ALA A 115 23.074 -24.343 13.068 1.00 12.21 C ATOM 1843 O ALA A 115 22.328 -23.734 13.835 1.00 45.42 O ATOM 1844 CB ALA A 115 22.677 -23.949 10.630 1.00 23.21 C ATOM 1845 HA ALA A 115 23.644 -22.601 11.980 1.00 0.00 H ATOM 1846 HB1 ALA A 115 23.041 -23.419 9.750 1.00 0.00 H ATOM 1847 HB2 ALA A 115 22.654 -25.020 10.428 1.00 0.00 H ATOM 1848 HB3 ALA A 115 21.673 -23.603 10.875 1.00 0.00 H ATOM 1849 H ALA A 115 25.122 -25.143 11.320 1.00 0.00 H ATOM 1850 N GLN A 116 23.461 -25.597 13.278 1.00 43.32 N ATOM 1851 CA GLN A 116 23.021 -26.346 14.449 1.00 44.12 C ATOM 1852 C GLN A 116 24.114 -26.385 15.512 1.00 62.51 C ATOM 1853 O GLN A 116 24.008 -25.731 16.548 1.00 11.44 O ATOM 1854 CB GLN A 116 22.628 -27.770 14.051 1.00 4.23 C ATOM 1855 CG GLN A 116 21.451 -27.830 13.091 1.00 22.53 C ATOM 1856 CD GLN A 116 20.120 -27.629 13.787 1.00 34.33 C ATOM 1857 OE1 GLN A 116 19.980 -26.757 14.645 1.00 30.23 O ATOM 1858 NE2 GLN A 116 19.132 -28.437 13.421 1.00 74.24 N ATOM 1859 HA GLN A 116 22.151 -25.840 14.868 1.00 0.00 H ATOM 1860 HB2 GLN A 116 23.486 -28.244 13.575 1.00 0.00 H ATOM 1861 HB3 GLN A 116 22.365 -28.321 14.954 1.00 0.00 H ATOM 1862 HG2 GLN A 116 21.573 -27.050 12.339 1.00 0.00 H ATOM 1863 HG3 GLN A 116 21.447 -28.805 12.604 1.00 0.00 H ATOM 1864 HE22 GLN A 116 19.295 -29.160 12.692 1.00 0.00 H ATOM 1865 HE21 GLN A 116 18.195 -28.347 13.864 1.00 0.00 H ATOM 1866 H GLN A 116 24.093 -26.055 12.591 1.00 0.00 H ATOM 1867 N GLN A 117 25.163 -27.158 15.247 1.00 10.20 N ATOM 1868 CA GLN A 117 26.275 -27.283 16.182 1.00 15.14 C ATOM 1869 C GLN A 117 25.780 -27.703 17.563 1.00 71.15 C ATOM 1870 O GLN A 117 26.404 -27.393 18.577 1.00 73.00 O ATOM 1871 CB GLN A 117 27.037 -25.960 16.281 1.00 34.35 C ATOM 1872 CG GLN A 117 28.533 -26.102 16.052 1.00 53.50 C ATOM 1873 CD GLN A 117 29.350 -25.210 16.966 1.00 40.23 C ATOM 1874 OE1 GLN A 117 28.828 -24.268 17.563 1.00 73.11 O ATOM 1875 NE2 GLN A 117 30.640 -25.502 17.080 1.00 62.33 N ATOM 1876 HA GLN A 117 26.948 -28.054 15.807 1.00 0.00 H ATOM 1877 HB2 GLN A 117 26.637 -25.275 15.534 1.00 0.00 H ATOM 1878 HB3 GLN A 117 26.878 -25.544 17.276 1.00 0.00 H ATOM 1879 HG2 GLN A 117 28.817 -27.139 16.231 1.00 0.00 H ATOM 1880 HG3 GLN A 117 28.755 -25.839 15.018 1.00 0.00 H ATOM 1881 HE22 GLN A 117 31.039 -26.307 16.557 1.00 0.00 H ATOM 1882 HE21 GLN A 117 31.252 -24.925 17.692 1.00 0.00 H ATOM 1883 H GLN A 117 25.191 -27.686 14.351 1.00 0.00 H ATOM 1884 N ALA A 118 24.655 -28.410 17.593 1.00 70.14 N ATOM 1885 CA ALA A 118 24.078 -28.874 18.848 1.00 33.00 C ATOM 1886 C ALA A 118 22.949 -29.869 18.599 1.00 50.42 C ATOM 1887 O ALA A 118 22.805 -30.853 19.324 1.00 51.35 O ATOM 1888 CB ALA A 118 23.573 -27.694 19.665 1.00 50.21 C ATOM 1889 HA ALA A 118 24.859 -29.384 19.411 1.00 0.00 H ATOM 1890 HB1 ALA A 118 24.403 -27.022 19.881 1.00 0.00 H ATOM 1891 HB2 ALA A 118 22.810 -27.161 19.098 1.00 0.00 H ATOM 1892 HB3 ALA A 118 23.145 -28.057 20.599 1.00 0.00 H ATOM 1893 H ALA A 118 24.175 -28.638 16.699 1.00 0.00 H ATOM 1894 N ALA A 119 22.150 -29.605 17.570 1.00 45.33 N ATOM 1895 CA ALA A 119 21.035 -30.478 17.225 1.00 43.34 C ATOM 1896 C ALA A 119 21.359 -31.323 15.998 1.00 64.33 C ATOM 1897 O ALA A 119 20.462 -31.750 15.272 1.00 41.13 O ATOM 1898 CB ALA A 119 19.777 -29.657 16.985 1.00 40.43 C ATOM 1899 HA ALA A 119 20.861 -31.153 18.063 1.00 0.00 H ATOM 1900 HB1 ALA A 119 19.529 -29.102 17.890 1.00 0.00 H ATOM 1901 HB2 ALA A 119 19.951 -28.960 16.166 1.00 0.00 H ATOM 1902 HB3 ALA A 119 18.953 -30.323 16.728 1.00 0.00 H ATOM 1903 H ALA A 119 22.325 -28.755 16.997 1.00 0.00 H ATOM 1904 N ALA A 120 22.647 -31.561 15.772 1.00 24.11 N ATOM 1905 CA ALA A 120 23.089 -32.357 14.634 1.00 43.24 C ATOM 1906 C ALA A 120 23.715 -33.670 15.091 1.00 34.14 C ATOM 1907 O ALA A 120 24.546 -34.250 14.393 1.00 41.45 O ATOM 1908 CB ALA A 120 24.077 -31.566 13.789 1.00 70.14 C ATOM 1909 HA ALA A 120 22.215 -32.594 14.027 1.00 0.00 H ATOM 1910 HB1 ALA A 120 23.596 -30.658 13.424 1.00 0.00 H ATOM 1911 HB2 ALA A 120 24.942 -31.301 14.397 1.00 0.00 H ATOM 1912 HB3 ALA A 120 24.398 -32.174 12.943 1.00 0.00 H ATOM 1913 H ALA A 120 23.357 -31.170 16.423 1.00 0.00 H ATOM 1914 N ASP A 121 23.310 -34.134 16.269 1.00 50.23 N ATOM 1915 CA ASP A 121 23.831 -35.380 16.820 1.00 53.52 C ATOM 1916 C ASP A 121 22.694 -36.289 17.276 1.00 40.01 C ATOM 1917 O ASP A 121 22.791 -36.953 18.309 1.00 40.41 O ATOM 1918 CB ASP A 121 24.771 -35.090 17.991 1.00 35.43 C ATOM 1919 CG ASP A 121 26.112 -34.549 17.537 1.00 12.24 C ATOM 1920 OD1 ASP A 121 26.648 -35.060 16.532 1.00 10.31 O ATOM 1921 OD2 ASP A 121 26.626 -33.615 18.188 1.00 51.30 O ATOM 1922 HA ASP A 121 24.388 -35.892 16.035 1.00 0.00 H ATOM 1923 HB2 ASP A 121 24.300 -34.355 18.644 1.00 0.00 H ATOM 1924 HB3 ASP A 121 24.936 -36.014 18.545 1.00 0.00 H ATOM 1925 H ASP A 121 22.604 -33.595 16.811 1.00 0.00 H ATOM 1926 N THR A 122 21.615 -36.314 16.499 1.00 21.45 N ATOM 1927 CA THR A 122 20.459 -37.140 16.824 1.00 30.13 C ATOM 1928 C THR A 122 20.581 -38.526 16.202 1.00 30.31 C ATOM 1929 O THR A 122 20.389 -39.538 16.874 1.00 33.45 O ATOM 1930 CB THR A 122 19.149 -36.487 16.343 1.00 24.21 C ATOM 1931 OG1 THR A 122 19.406 -35.653 15.208 1.00 61.33 O ATOM 1932 CG2 THR A 122 18.517 -35.661 17.453 1.00 70.01 C ATOM 1933 HA THR A 122 20.433 -37.233 17.910 1.00 0.00 H ATOM 1934 HB THR A 122 18.455 -37.279 16.062 1.00 0.00 H ATOM 1935 HG1 THR A 122 18.559 -35.238 14.906 1.00 0.00 H ATOM 1936 HG23 THR A 122 18.323 -36.300 18.314 1.00 0.00 H ATOM 1937 HG21 THR A 122 19.197 -34.859 17.740 1.00 0.00 H ATOM 1938 HG22 THR A 122 17.579 -35.234 17.098 1.00 0.00 H ATOM 1939 H THR A 122 21.596 -35.730 15.639 1.00 0.00 H ATOM 1940 N GLY A 123 20.903 -38.565 14.912 1.00 33.04 N ATOM 1941 CA GLY A 123 21.045 -39.833 14.221 1.00 24.03 C ATOM 1942 C GLY A 123 22.384 -40.492 14.490 1.00 73.24 C ATOM 1943 O GLY A 123 22.934 -40.372 15.583 1.00 1.22 O ATOM 1944 HA3 GLY A 123 20.949 -39.660 13.149 1.00 0.00 H ATOM 1945 HA2 GLY A 123 20.252 -40.503 14.553 1.00 0.00 H ATOM 1946 H GLY A 123 21.055 -37.677 14.393 1.00 0.00 H ATOM 1947 N ASN A 124 22.908 -41.193 13.489 1.00 11.31 N ATOM 1948 CA ASN A 124 24.189 -41.876 13.623 1.00 4.23 C ATOM 1949 C ASN A 124 24.854 -42.058 12.262 1.00 1.32 C ATOM 1950 O ASN A 124 24.391 -42.841 11.434 1.00 44.20 O ATOM 1951 CB ASN A 124 23.997 -43.237 14.296 1.00 45.24 C ATOM 1952 CG ASN A 124 25.315 -43.936 14.573 1.00 55.43 C ATOM 1953 OD1 ASN A 124 26.057 -44.273 13.650 1.00 1.15 O ATOM 1954 ND2 ASN A 124 25.610 -44.157 15.848 1.00 11.44 N ATOM 1955 HA ASN A 124 24.838 -41.259 14.245 1.00 0.00 H ATOM 1956 HB2 ASN A 124 23.473 -43.090 15.240 1.00 0.00 H ATOM 1957 HB3 ASN A 124 23.396 -43.869 13.643 1.00 0.00 H ATOM 1958 HD22 ASN A 124 24.952 -43.854 16.594 1.00 0.00 H ATOM 1959 HD21 ASN A 124 26.499 -44.633 16.101 1.00 0.00 H ATOM 1960 H ASN A 124 22.391 -41.256 12.589 1.00 0.00 H ATOM 1961 N ASN A 125 25.943 -41.329 12.039 1.00 13.53 N ATOM 1962 CA ASN A 125 26.672 -41.409 10.779 1.00 72.23 C ATOM 1963 C ASN A 125 28.115 -40.947 10.954 1.00 0.14 C ATOM 1964 O ASN A 125 28.374 -39.901 11.549 1.00 5.20 O ATOM 1965 CB ASN A 125 25.979 -40.561 9.710 1.00 63.21 C ATOM 1966 CG ASN A 125 26.290 -39.084 9.853 1.00 12.23 C ATOM 1967 OD1 ASN A 125 25.857 -38.437 10.807 1.00 12.20 O ATOM 1968 ND2 ASN A 125 27.044 -38.543 8.903 1.00 15.22 N ATOM 1969 HA ASN A 125 26.680 -42.451 10.459 1.00 0.00 H ATOM 1970 HB2 ASN A 125 26.312 -40.896 8.727 1.00 0.00 H ATOM 1971 HB3 ASN A 125 24.902 -40.702 9.795 1.00 0.00 H ATOM 1972 HD22 ASN A 125 27.388 -39.129 8.115 1.00 0.00 H ATOM 1973 HD21 ASN A 125 27.291 -37.534 8.947 1.00 0.00 H ATOM 1974 H ASN A 125 26.283 -40.686 12.782 1.00 0.00 H ATOM 1975 N SER A 126 29.050 -41.734 10.432 1.00 5.34 N ATOM 1976 CA SER A 126 30.468 -41.407 10.534 1.00 20.21 C ATOM 1977 C SER A 126 31.173 -41.624 9.198 1.00 34.13 C ATOM 1978 O SER A 126 30.696 -42.376 8.349 1.00 60.22 O ATOM 1979 CB SER A 126 31.133 -42.258 11.618 1.00 14.12 C ATOM 1980 OG SER A 126 30.248 -42.485 12.702 1.00 70.44 O ATOM 1981 HA SER A 126 30.554 -40.355 10.804 1.00 0.00 H ATOM 1982 HB2 SER A 126 32.019 -41.740 11.984 1.00 0.00 H ATOM 1983 HB3 SER A 126 31.425 -43.217 11.189 1.00 0.00 H ATOM 1984 HG SER A 126 30.702 -43.037 13.387 1.00 0.00 H ATOM 1985 H SER A 126 28.764 -42.604 9.939 1.00 0.00 H ATOM 1986 N GLN A 127 32.310 -40.959 9.022 1.00 72.35 N ATOM 1987 CA GLN A 127 33.080 -41.078 7.789 1.00 21.42 C ATOM 1988 C GLN A 127 33.552 -42.513 7.579 1.00 24.21 C ATOM 1989 O GLN A 127 33.372 -43.370 8.444 1.00 31.32 O ATOM 1990 CB GLN A 127 34.282 -40.133 7.821 1.00 40.22 C ATOM 1991 CG GLN A 127 33.900 -38.662 7.795 1.00 54.31 C ATOM 1992 CD GLN A 127 34.607 -37.894 6.696 1.00 70.15 C ATOM 1993 OE1 GLN A 127 34.184 -37.911 5.539 1.00 33.33 O ATOM 1994 NE2 GLN A 127 35.691 -37.215 7.051 1.00 42.32 N ATOM 1995 HA GLN A 127 32.432 -40.802 6.957 1.00 0.00 H ATOM 1996 HB2 GLN A 127 34.849 -40.326 8.732 1.00 0.00 H ATOM 1997 HB3 GLN A 127 34.908 -40.342 6.954 1.00 0.00 H ATOM 1998 HG2 GLN A 127 32.824 -38.583 7.639 1.00 0.00 H ATOM 1999 HG3 GLN A 127 34.160 -38.217 8.755 1.00 0.00 H ATOM 2000 HE22 GLN A 127 36.013 -37.229 8.040 1.00 0.00 H ATOM 2001 HE21 GLN A 127 36.219 -36.669 6.340 1.00 0.00 H ATOM 2002 H GLN A 127 32.659 -40.339 9.781 1.00 0.00 H ATOM 2003 N VAL A 128 34.158 -42.769 6.424 1.00 50.54 N ATOM 2004 CA VAL A 128 34.657 -44.100 6.100 1.00 40.43 C ATOM 2005 C VAL A 128 36.166 -44.183 6.296 1.00 25.54 C ATOM 2006 O VAL A 128 36.880 -43.193 6.137 1.00 54.13 O ATOM 2007 CB VAL A 128 34.317 -44.489 4.649 1.00 40.23 C ATOM 2008 CG1 VAL A 128 35.072 -43.605 3.668 1.00 62.13 C ATOM 2009 CG2 VAL A 128 34.628 -45.958 4.405 1.00 45.33 C ATOM 2010 HA VAL A 128 34.166 -44.797 6.780 1.00 0.00 H ATOM 2011 HB VAL A 128 33.249 -44.336 4.491 1.00 0.00 H ATOM 2012 HG11 VAL A 128 34.793 -42.564 3.830 1.00 0.00 H ATOM 2013 HG12 VAL A 128 36.144 -43.724 3.825 1.00 0.00 H ATOM 2014 HG13 VAL A 128 34.818 -43.896 2.649 1.00 0.00 H ATOM 2015 HG21 VAL A 128 35.689 -46.138 4.581 1.00 0.00 H ATOM 2016 HG22 VAL A 128 34.036 -46.571 5.085 1.00 0.00 H ATOM 2017 HG23 VAL A 128 34.381 -46.214 3.375 1.00 0.00 H ATOM 2018 H VAL A 128 34.279 -42.000 5.734 1.00 0.00 H ATOM 2019 N SER A 129 36.647 -45.373 6.644 1.00 43.03 N ATOM 2020 CA SER A 129 38.073 -45.586 6.866 1.00 73.23 C ATOM 2021 C SER A 129 38.572 -46.790 6.072 1.00 11.04 C ATOM 2022 O SER A 129 38.058 -47.899 6.219 1.00 40.45 O ATOM 2023 CB SER A 129 38.353 -45.791 8.356 1.00 43.14 C ATOM 2024 OG SER A 129 37.437 -46.709 8.926 1.00 53.02 O ATOM 2025 HA SER A 129 38.606 -44.700 6.522 1.00 0.00 H ATOM 2026 HB2 SER A 129 38.265 -44.834 8.870 1.00 0.00 H ATOM 2027 HB3 SER A 129 39.366 -46.176 8.479 1.00 0.00 H ATOM 2028 HG SER A 129 37.517 -47.582 8.465 1.00 0.00 H ATOM 2029 H SER A 129 35.991 -46.171 6.761 1.00 0.00 H ATOM 2030 N GLN A 130 39.577 -46.562 5.233 1.00 53.12 N ATOM 2031 CA GLN A 130 40.145 -47.627 4.416 1.00 63.25 C ATOM 2032 C GLN A 130 41.669 -47.600 4.469 1.00 2.11 C ATOM 2033 O GLN A 130 42.261 -46.749 5.132 1.00 64.42 O ATOM 2034 CB GLN A 130 39.672 -47.496 2.967 1.00 14.40 C ATOM 2035 CG GLN A 130 40.158 -46.230 2.280 1.00 3.44 C ATOM 2036 CD GLN A 130 39.023 -45.306 1.887 1.00 54.23 C ATOM 2037 OE1 GLN A 130 38.622 -44.433 2.657 1.00 13.20 O ATOM 2038 NE2 GLN A 130 38.497 -45.493 0.682 1.00 62.33 N ATOM 2039 HA GLN A 130 39.802 -48.580 4.818 1.00 0.00 H ATOM 2040 HB2 GLN A 130 40.038 -48.355 2.406 1.00 0.00 H ATOM 2041 HB3 GLN A 130 38.582 -47.496 2.959 1.00 0.00 H ATOM 2042 HG2 GLN A 130 40.823 -45.697 2.960 1.00 0.00 H ATOM 2043 HG3 GLN A 130 40.708 -46.510 1.381 1.00 0.00 H ATOM 2044 HE22 GLN A 130 38.867 -46.243 0.064 1.00 0.00 H ATOM 2045 HE21 GLN A 130 37.715 -44.889 0.357 1.00 0.00 H ATOM 2046 H GLN A 130 39.967 -45.601 5.158 1.00 0.00 H ATOM 2047 N ASN A 131 42.298 -48.537 3.767 1.00 50.01 N ATOM 2048 CA ASN A 131 43.754 -48.621 3.735 1.00 14.24 C ATOM 2049 C ASN A 131 44.311 -47.938 2.490 1.00 0.42 C ATOM 2050 O ASN A 131 43.761 -48.072 1.397 1.00 52.30 O ATOM 2051 CB ASN A 131 44.202 -50.083 3.772 1.00 20.13 C ATOM 2052 CG ASN A 131 45.247 -50.341 4.841 1.00 42.44 C ATOM 2053 OD1 ASN A 131 45.922 -49.419 5.299 1.00 3.11 O ATOM 2054 ND2 ASN A 131 45.385 -51.599 5.242 1.00 44.12 N ATOM 2055 HA ASN A 131 44.142 -48.107 4.614 1.00 0.00 H ATOM 2056 HB2 ASN A 131 43.334 -50.711 3.972 1.00 0.00 H ATOM 2057 HB3 ASN A 131 44.622 -50.345 2.801 1.00 0.00 H ATOM 2058 HD22 ASN A 131 44.792 -52.345 4.826 1.00 0.00 H ATOM 2059 HD21 ASN A 131 46.086 -51.838 5.972 1.00 0.00 H ATOM 2060 H ASN A 131 41.738 -49.227 3.227 1.00 0.00 H ATOM 2061 N TYR A 132 45.406 -47.206 2.664 1.00 52.21 N ATOM 2062 CA TYR A 132 46.037 -46.500 1.555 1.00 2.02 C ATOM 2063 C TYR A 132 45.074 -45.495 0.930 1.00 4.03 C ATOM 2064 O TYR A 132 45.392 -44.308 0.877 1.00 41.14 O ATOM 2065 CB TYR A 132 46.513 -47.494 0.495 1.00 61.41 C ATOM 2066 CG TYR A 132 47.364 -48.613 1.052 1.00 1.05 C ATOM 2067 CD1 TYR A 132 48.587 -48.347 1.657 1.00 15.12 C ATOM 2068 CD2 TYR A 132 46.946 -49.936 0.974 1.00 44.31 C ATOM 2069 CE1 TYR A 132 49.368 -49.366 2.167 1.00 12.44 C ATOM 2070 CE2 TYR A 132 47.720 -50.961 1.483 1.00 44.43 C ATOM 2071 CZ TYR A 132 48.930 -50.671 2.078 1.00 2.42 C ATOM 2072 OH TYR A 132 49.705 -51.689 2.585 1.00 12.20 O ATOM 2073 HA TYR A 132 46.897 -45.957 1.946 1.00 0.00 H ATOM 2074 HB3 TYR A 132 47.099 -46.952 -0.247 1.00 0.00 H ATOM 2075 HB2 TYR A 132 45.638 -47.932 0.016 1.00 0.00 H ATOM 2076 HD2 TYR A 132 45.991 -50.169 0.503 1.00 0.00 H ATOM 2077 HE2 TYR A 132 47.376 -51.993 1.415 1.00 0.00 H ATOM 2078 HE1 TYR A 132 50.325 -49.140 2.637 1.00 0.00 H ATOM 2079 HD1 TYR A 132 48.936 -47.317 1.730 1.00 0.00 H ATOM 2080 HH TYR A 132 50.533 -51.310 2.973 1.00 0.00 H ATOM 2081 H TYR A 132 45.823 -47.135 3.614 1.00 0.00 H TER 2082 TYR A 132 HETATM 2083 N UNN A 1 -7.482 -26.781 4.650 1.00 0.23 N HETATM 2084 CA UNN A 1 -6.530 -25.760 5.125 1.00 0.06 C HETATM 2085 CB UNN A 1 -5.284 -26.455 5.731 1.00 0.14 C HETATM 2086 OG UNN A 1 -4.477 -25.566 6.534 1.00 -0.25 O HETATM 2087 P UNN A 1 -2.907 -25.842 6.651 1.00 0.26 P HETATM 2088 O2P UNN A 1 -2.195 -24.808 7.405 1.00 -0.62 O HETATM 2089 O3G UNN A 1 -2.318 -25.942 5.164 1.00 -0.25 O HETATM 2090 C3G UNN A 1 -1.891 -27.252 4.715 1.00 0.12 C HETATM 2091 C2G UNN A 1 -1.147 -27.210 3.351 1.00 0.14 C HETATM 2092 C1G UNN A 1 -2.013 -27.717 2.172 1.00 0.11 C HETATM 2093 O1G UNN A 1 -1.645 -29.053 1.809 1.00 -0.27 O HETATM 2094 C1A UNN A 1 -2.147 -30.210 2.325 1.00 0.23 C HETATM 2095 O1A UNN A 1 -3.299 -30.245 2.822 1.00 -0.37 O HETATM 2096 C2A UNN A 1 -1.270 -31.400 2.292 1.00 0.05 C HETATM 2097 C3A UNN A 1 -1.655 -32.546 3.268 1.00 -0.03 C HETATM 2098 C4A UNN A 1 -0.693 -33.760 3.162 1.00 -0.05 C HETATM 2099 C5A UNN A 1 -0.895 -34.788 4.306 1.00 -0.05 C HETATM 2100 C6A UNN A 1 -0.037 -34.463 5.559 1.00 -0.05 C HETATM 2101 C7A UNN A 1 -0.768 -34.804 6.886 1.00 -0.06 C HETATM 2102 C8A UNN A 1 0.043 -34.397 8.136 1.00 -0.07 C HETATM 2103 H36 UNN A 1 -0.522 -34.662 9.042 1.00 0.02 H HETATM 2104 H37 UNN A 1 0.222 -33.312 8.120 1.00 0.02 H HETATM 2105 H38 UNN A 1 1.007 -34.928 8.137 1.00 0.02 H HETATM 2106 H32 UNN A 1 -0.947 -35.889 6.920 1.00 0.03 H HETATM 2107 H33 UNN A 1 -1.731 -34.273 6.904 1.00 0.03 H HETATM 2108 H28 UNN A 1 0.202 -33.389 5.554 1.00 0.03 H HETATM 2109 H29 UNN A 1 0.894 -35.046 5.510 1.00 0.03 H HETATM 2110 H24 UNN A 1 -0.615 -35.786 3.937 1.00 0.03 H HETATM 2111 H25 UNN A 1 -1.956 -34.788 4.596 1.00 0.03 H HETATM 2112 H20 UNN A 1 0.343 -33.392 3.199 1.00 0.03 H HETATM 2113 H21 UNN A 1 -0.869 -34.265 2.201 1.00 0.03 H HETATM 2114 H14 UNN A 1 -2.676 -32.882 3.033 1.00 0.03 H HETATM 2115 H15 UNN A 1 -1.624 -32.159 4.297 1.00 0.03 H HETATM 2116 H8 UNN A 1 -0.249 -31.075 2.539 1.00 0.05 H HETATM 2117 H9 UNN A 1 -1.289 -31.806 1.270 1.00 0.05 H HETATM 2118 H6 UNN A 1 -3.072 -27.703 2.470 1.00 0.06 H HETATM 2119 H7 UNN A 1 -1.867 -27.055 1.306 1.00 0.06 H HETATM 2120 O2G UNN A 1 -0.693 -25.889 3.004 1.00 -0.27 O HETATM 2121 C1B UNN A 1 0.436 -25.533 2.323 1.00 0.23 C HETATM 2122 O1B UNN A 1 0.525 -25.725 1.087 1.00 -0.37 O HETATM 2123 C2B UNN A 1 1.520 -24.882 3.091 1.00 0.05 C HETATM 2124 C3B UNN A 1 2.165 -23.639 2.413 1.00 -0.03 C HETATM 2125 C4B UNN A 1 3.712 -23.604 2.561 1.00 -0.05 C HETATM 2126 C5B UNN A 1 4.312 -22.210 2.234 1.00 -0.05 C HETATM 2127 C6B UNN A 1 4.974 -22.149 0.831 1.00 -0.05 C HETATM 2128 C7B UNN A 1 4.222 -21.201 -0.142 1.00 -0.06 C HETATM 2129 C8B UNN A 1 5.163 -20.221 -0.880 1.00 -0.07 C HETATM 2130 H39 UNN A 1 4.572 -19.580 -1.551 1.00 0.02 H HETATM 2131 H40 UNN A 1 5.896 -20.791 -1.470 1.00 0.02 H HETATM 2132 H41 UNN A 1 5.690 -19.595 -0.145 1.00 0.02 H HETATM 2133 H34 UNN A 1 3.490 -20.616 0.434 1.00 0.03 H HETATM 2134 H35 UNN A 1 3.696 -21.812 -0.890 1.00 0.03 H HETATM 2135 H30 UNN A 1 4.982 -23.161 0.401 1.00 0.03 H HETATM 2136 H31 UNN A 1 6.008 -21.790 0.944 1.00 0.03 H HETATM 2137 H26 UNN A 1 5.073 -21.969 2.991 1.00 0.03 H HETATM 2138 H27 UNN A 1 3.506 -21.463 2.274 1.00 0.03 H HETATM 2139 H22 UNN A 1 4.148 -24.345 1.875 1.00 0.03 H HETATM 2140 H23 UNN A 1 3.973 -23.865 3.597 1.00 0.03 H HETATM 2141 H16 UNN A 1 1.748 -22.732 2.874 1.00 0.03 H HETATM 2142 H17 UNN A 1 1.915 -23.654 1.342 1.00 0.03 H HETATM 2143 H10 UNN A 1 2.312 -25.627 3.258 1.00 0.05 H HETATM 2144 H11 UNN A 1 1.106 -24.564 4.059 1.00 0.05 H HETATM 2145 H13 UNN A 1 -0.268 -27.866 3.440 1.00 0.07 H HETATM 2146 H18 UNN A 1 -1.215 -27.679 5.471 1.00 0.07 H HETATM 2147 H19 UNN A 1 -2.778 -27.894 4.612 1.00 0.07 H HETATM 2148 O3P UNN A 1 -2.696 -27.251 7.340 1.00 -0.62 O HETATM 2149 H4 UNN A 1 -5.621 -27.290 6.363 1.00 0.07 H HETATM 2150 H5 UNN A 1 -4.665 -26.844 4.909 1.00 0.07 H HETATM 2151 C UNN A 1 -6.206 -24.857 4.004 1.00 0.09 C HETATM 2152 O UNN A 1 -5.119 -24.238 3.962 1.00 -0.56 O HETATM 2153 OXT UNN A 1 -7.068 -24.713 2.968 1.00 -0.56 O HETATM 2154 H12 UNN A 1 -7.008 -25.166 5.918 1.00 0.11 H HETATM 2155 H1 UNN A 1 -7.711 -27.405 5.408 1.00 0.20 H HETATM 2156 H2 UNN A 1 -7.064 -27.306 3.898 1.00 0.20 H HETATM 2157 H3 UNN A 1 -8.321 -26.330 4.320 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 2083 2084 2155 2156 2157 CONECT 2084 2083 2085 2151 2154 CONECT 2085 2084 2086 2149 2150 CONECT 2086 2085 2087 CONECT 2087 2086 2088 2089 2148 CONECT 2088 2087 CONECT 2089 2087 2090 CONECT 2090 2089 2091 2146 2147 CONECT 2091 2090 2092 2120 2145 CONECT 2092 2091 2093 2118 2119 CONECT 2093 2092 2094 CONECT 2094 2093 2095 2096 CONECT 2095 2094 CONECT 2096 2094 2097 2116 2117 CONECT 2097 2096 2098 2114 2115 CONECT 2098 2097 2099 2112 2113 CONECT 2099 2098 2100 2110 2111 CONECT 2100 2099 2101 2108 2109 CONECT 2101 2100 2102 2106 2107 CONECT 2102 2101 2103 2104 2105 CONECT 2103 2102 CONECT 2104 2102 CONECT 2105 2102 CONECT 2106 2101 CONECT 2107 2101 CONECT 2108 2100 CONECT 2109 2100 CONECT 2110 2099 CONECT 2111 2099 CONECT 2112 2098 CONECT 2113 2098 CONECT 2114 2097 CONECT 2115 2097 CONECT 2116 2096 CONECT 2117 2096 CONECT 2118 2092 CONECT 2119 2092 CONECT 2120 2091 2121 CONECT 2121 2120 2122 2123 CONECT 2122 2121 CONECT 2123 2121 2124 2143 2144 CONECT 2124 2123 2125 2141 2142 CONECT 2125 2124 2126 2139 2140 CONECT 2126 2125 2127 2137 2138 CONECT 2127 2126 2128 2135 2136 CONECT 2128 2127 2129 2133 2134 CONECT 2129 2128 2130 2131 2132 CONECT 2130 2129 CONECT 2131 2129 CONECT 2132 2129 CONECT 2133 2128 CONECT 2134 2128 CONECT 2135 2127 CONECT 2136 2127 CONECT 2137 2126 CONECT 2138 2126 CONECT 2139 2125 CONECT 2140 2125 CONECT 2141 2124 CONECT 2142 2124 CONECT 2143 2123 CONECT 2144 2123 CONECT 2145 2091 CONECT 2146 2090 CONECT 2147 2090 CONECT 2148 2087 CONECT 2149 2085 CONECT 2150 2085 CONECT 2151 2084 2152 2153 CONECT 2152 2151 CONECT 2153 2151 CONECT 2154 2084 CONECT 2155 2083 CONECT 2156 2083 CONECT 2157 2083 MASTER 0 0 0 0 0 0 0 0 2156 1 79 11 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
2lyb
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Matrix protein p17
Ligand Name
8SP
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=35uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) Proc.Natl.Acad.Sci.USA Vol. 110: pp. 3525-3530
Ligand Properties
Formula
C
2
2
H
4
4
NO
1
0
P
Molecular Weight
513.559
Exact Mass
513.270
No. of atoms
78
No. of bonds
77
Polar Surface Area
190.05
LOGP Value
2.03 (
Computed with XLOGP3
)
2.55 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 23
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 0
Canonical SMILES
CCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCC)COP(OC[C@@H](C(=O)O)[NH3+])(O)O
InChI String
InChI=1S/C22H44NO10P/c1-3-5-7-9-11-13-20(24)30-15-18(33-21(25)14-12-10-8-6-4-2)16-31-34(28,29)32-17-19(23)22(26)27/h18-19,28-29,34H,3-17,23H2,1-2H3,(H,26,27)/p+1/t18-,19+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P12497
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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